data_r4kotsf
# 
_audit.revision_id    1_0
_audit.creation_date  2013-06-05
_audit.update_record   'Initial release'
# 
_cell.entry_id      4kot 
_cell.length_a      58.7500 
_cell.length_b      76.2960 
_cell.length_c      39.2980 
_cell.angle_alpha   90.0000 
_cell.angle_beta    90.0000 
_cell.angle_gamma   90.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97856 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   1.551 
_diffrn_reflns.pdbx_d_res_low    46.549 
_diffrn_reflns.limit_h_max       37 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       49 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       25 
_diffrn_reflns.limit_l_min       0 
_diffrn_reflns.number            26307 
_diffrn_reflns.pdbx_number_obs   26196 
# 
_entry.id   4kot 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               4kot 
_symmetry.space_group_name_H-M   'P 21 21 2' 
_symmetry.Int_Tables_number      18 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 'X,  Y,  Z'           
2 '-X,  -Y,  Z'         
3 'X+1/2,  -Y+1/2,  -Z' 
4 '-X+1/2,  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.F_calc
_refln.phase_calc
_refln.pdbx_I_plus
_refln.pdbx_I_plus_sigma
_refln.pdbx_I_minus
_refln.pdbx_I_minus_sigma
1 1 1    0    0    1 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1    0    0    2 o 149.2913 2.822308   1612.984     0.0   223.1654 8.420200   223.1654 8.420200 
1 1 1    0    0    3 o 262.0384 3.254639   46.75701   180.0   687.0583 17.05091   687.0583 17.05091 
1 1 1    0    0    4 o 110.2126 1.637945   8.973914     0.0   121.5516 3.608657   121.5516 3.608657 
1 1 1    0    0    5 o 22.93333 1.053800   310.0261   180.0   5.292697 0.4811543   5.292697 0.4811543 
1 1 1    0    0    6 o 142.4936 2.100891   344.5457     0.0   203.1975 5.984357   203.1975 5.984357 
1 1 1    0    0    7 o 328.4582 4.071043   181.3795   180.0   1079.680 26.73414   1079.680 26.73414 
1 1 1    0    0    8 o 246.8814 3.223054   210.3682     0.0   609.8932 15.90816   609.8932 15.90816 
1 1 1    0    0    9 o 207.7809 2.917599   52.96142   180.0   432.0164 12.11907   432.0164 12.11907 
1 1 1    0    0   10 o 452.5016 5.451292   420.0960   180.0   2049.146 49.31832   2049.146 49.31832 
1 1 1    0    0   11 o 171.4179 2.606511   219.5745   180.0   294.0755 8.931427   294.0755 8.931427 
1 1 1    0    0   12 o 366.1694 4.460943   444.3979     0.0   1342.060 32.65835   1342.060 32.65835 
1 1 1    0    0   13 o 95.67290 2.360607   47.02047     0.0   91.72004 4.510822   91.72004 4.510822 
1 1 1    0    0   14 o 143.4278 2.969630   219.1668   180.0   206.0844 8.510417   206.0844 8.510417 
1 1 1    0    0   15 o 74.37189 2.025062   90.98317     0.0   55.45303 3.007215   55.45303 3.007215 
1 1 1    0    0   16 o 31.80160 3.079082   61.57499   180.0   10.40496 1.924617   10.40496 1.924617 
1 1 1    0    0   17 o 102.0443 2.611861   135.4091   180.0   104.4406 5.322770   104.4406 5.322770 
1 1 1    0    0   18 o 63.76114 2.412875   26.34409     0.0   40.86804 3.067359   40.86804 3.067359 
1 1 1    0    0   19 o 30.51586 3.686418   17.35668   180.0   9.743376 2.195267   9.743376 2.195267 
1 1 1    0    0   20 o 45.29858 2.640977   116.0514     0.0   20.77985 2.375700   20.77985 2.375700 
1 1 1    0    0   21 o 14.49900 6.480575   16.17527     0.0   3.097431 1.984761   3.097431 1.984761 
1 1 1    0    0   22 o 33.60399 3.325815   32.22178     0.0   11.72814 2.195267   11.72814 2.195267 
1 1 1    0    0   23 o 32.87186 3.694120   43.04216     0.0   11.39734 2.375700   11.39734 2.375700 
1 1 1    0    0   24 o 99.70607 2.946352   111.5621     0.0   101.3131 5.864068   101.3131 5.864068 
1 1 1    0    0   25 x        ?      ?   25.72619     0.0          ?        ?          ?        ? 
1 1 1    0    1    1 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1    0    1    2 o 30.38464 0.9920371   807.2510   270.0   9.262220 0.6014429   9.262220 0.6014429 
1 1 1    0    1    3 o 23.81992 0.5688359   522.8081   270.0   5.683635 0.2706493   5.683635 0.2706493 
1 1 1    0    1    4 o 155.6428 1.739400   249.9028   270.0   242.3514 5.412986   242.3514 5.412986 
1 1 1    0    1    5 o 183.5163 1.720936   418.9823    90.0   336.8983 6.315150   336.8983 6.315150 
1 1 1    0    1    6 o 185.3741 1.801069   251.9931   270.0   343.7847 6.676016   343.7847 6.676016 
1 1 1    0    1    7 o 217.2348 2.014568   382.4650   270.0   472.1026 8.750995   472.1026 8.750995 
1 1 1    0    1    8 o 455.1000 4.421563   432.8923   270.0   2072.723 40.23653   2072.723 40.23653 
1 1 1    0    1    9 o 311.4030 3.260034   375.6198    90.0   970.2176 20.29870   970.2176 20.29870 
1 1 1    0    1   10 o 250.1151 2.681893   399.7593    90.0   625.8915 13.41218   625.8915 13.41218 
1 1 1    0    1   11 o 228.1888 2.544184   298.7740   270.0   520.9999 11.60785   520.9999 11.60785 
1 1 1    0    1   12 f 102.2294 1.530417   119.3716   270.0   104.5909 3.127503   104.5909 3.127503 
1 1 1    0    1   13 o 22.88631 2.412838   67.85095   270.0   5.412986 1.082597   5.412986 1.082597 
1 1 1    0    1   14 o 77.80310 1.295632   114.6919    90.0   60.59537 2.014834   60.59537 2.014834 
1 1 1    0    1   15 o 103.7404 1.435516   100.6779    90.0   107.7184 2.977142   107.7184 2.977142 
1 1 1    0    1   16 o 12.37608 5.144628   26.75565   270.0   2.165194 1.263030   2.165194 1.263030 
1 1 1    0    1   17 o 68.22663 1.677169   65.36386   270.0   46.67197 2.285483   46.67197 2.285483 
1 1 1    0    1   18 o 44.50965 1.865066   58.78340    90.0   19.93783 1.653968   19.93783 1.653968 
1 1 1    0    1   19 o 95.63280 1.778039   89.11665   270.0   91.68996 3.398152   91.68996 3.398152 
1 1 1    0    1   20 o 9.147844 5.048995   5.341276   270.0   1.202886 1.323174   1.202886 1.323174 
1 1 1    0    1   21 o 11.22333 5.534288   19.01705    90.0   1.924617 1.473535   1.924617 1.473535 
1 1 1    0    1   22 x        ?      ?   8.245809   270.0          ?        ?          ?        ? 
1 1 1    0    1   23 x        ?      ?   9.705670    90.0          ?        ?          ?        ? 
1 1 1    0    1   24 x        ?      ?   14.16226   270.0          ?        ?          ?        ? 
1 1 1    0    1   25 x        ?      ?   31.04775    90.0          ?        ?          ?        ? 
1 1 1    0    2    0 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1    0    2    1 o 317.8499 5.405792   266.1096     0.0   1013.521 34.34239   1013.521 34.34239 
1 1 1    0    2    2 o 92.52780 1.349420   195.8378   180.0   85.67554 2.495988   85.67554 2.495988 
1 1 1    0    2    3 o 359.8844 4.246203   1045.507   180.0   1296.290 30.55330   1296.290 30.55330 
1 1 1    0    2    4 o 18.44959 0.9010605   135.8208     0.0   3.428224 0.3307936   3.428224 0.3307936 
1 1 1    0    2    5 o 71.93734 1.045576   317.5521     0.0   51.78423 1.503607   51.78423 1.503607 
1 1 1    0    2    6 o 130.6576 1.588630   319.1050   180.0   170.8098 4.149956   170.8098 4.149956 
1 1 1    0    2    7 f 26.06451 1.041995   60.22799     0.0   6.826377 0.5412986   6.826377 0.5412986 
1 1 1    0    2    8 o 133.6635 1.620419   246.6501   180.0   178.7488 4.330389   178.7488 4.330389 
1 1 1    0    2    9 o 376.4089 3.799744   472.7296     0.0   1417.631 28.59861   1417.631 28.59861 
1 1 1    0    2   10 o 27.89659 1.793893   34.70314   180.0   7.878902 0.9923807   7.878902 0.9923807 
1 1 1    0    2   11 o 254.2796 2.679349   205.6689   180.0   646.9421 13.62268   646.9421 13.62268 
1 1 1    0    2   12 o 176.0487 2.110273   171.5380     0.0   310.1340 7.427820   310.1340 7.427820 
1 1 1    0    2   13 o 175.5675 1.961767   184.9008     0.0   308.4500 6.886521   308.4500 6.886521 
1 1 1    0    2   14 f 8.054622 4.348615   41.10182   180.0  0.9322364 0.9623086  0.9322364 0.9623086 
1 1 1    0    2   15 o 217.9190 2.339653   233.8118   180.0   475.4707 10.19446   475.4707 10.19446 
1 1 1    0    2   16 o 125.4188 1.583073   161.6141   180.0   157.4577 3.969523   157.4577 3.969523 
1 1 1    0    2   17 o 35.05711 1.724496   66.48361   180.0   12.38972 1.202886   12.38972 1.202886 
1 1 1    0    2   18 o 46.08554 1.965301   48.95280   180.0   21.38129 1.804329   21.38129 1.804329 
1 1 1    0    2   19 f 63.59771 1.562496   42.58722     0.0   40.56732 1.984761   40.56732 1.984761 
1 1 1    0    2   20 o 45.20621 1.903170   62.16454   180.0   20.59942 1.714112   20.59942 1.714112 
1 1 1    0    2   21 o 15.77818 6.599264   3.591707   180.0   3.638730 2.074978   3.638730 2.074978 
1 1 1    0    2   22 x        ?      ?   23.62943   180.0          ?        ?          ?        ? 
1 1 1    0    2   23 x        ?      ?   63.44096   180.0          ?        ?          ?        ? 
1 1 1    0    2   24 x        ?      ?   56.08165   180.0          ?        ?          ?        ? 
1 1 1    0    2   25 x        ?      ?   1.462775     0.0          ?        ?          ?        ? 
1 1 1    0    3    1 o 191.6493 2.040380   1836.952    90.0   367.5117 7.818758   367.5117 7.818758 
1 1 1    0    3    2 o 139.6316 1.928365   983.9288    90.0   195.1081 5.382914   195.1081 5.382914 
1 1 1    0    3    3 o 238.2090 3.005648   243.8688    90.0   567.8222 14.31434   567.8222 14.31434 
1 1 1    0    3    4 o 183.6948 2.415616   715.8482    90.0   337.6501 8.871283   337.6501 8.871283 
1 1 1    0    3    5 o 77.55779 1.280317   186.1807   270.0   60.20443 1.984761   60.20443 1.984761 
1 1 1    0    3    6 o 55.27185 1.034555   61.97223   270.0   30.58337 1.142741   30.58337 1.142741 
1 1 1    0    3    7 o 90.54362 1.295897   6.055926    90.0   82.03680 2.345627   82.03680 2.345627 
1 1 1    0    3    8 o 446.7996 4.301728   642.0950    90.0   1997.662 38.43220   1997.662 38.43220 
1 1 1    0    3    9 o 208.4752 2.265295   282.5148    90.0   434.8131 9.442654   434.8131 9.442654 
1 1 1    0    3   10 o 5.559827 3.541694   16.41884    90.0  0.1202886 0.8420200  0.1202886 0.8420200 
1 1 1    0    3   11 o 16.87036 3.664057   65.64174    90.0   3.217719 1.082597   3.217719 1.082597 
1 1 1    0    3   12 o 6.364355 3.933483   45.42925    90.0  0.3307936 0.9623086  0.3307936 0.9623086 
1 1 1    0    3   13 o 142.2258 1.692052   75.14006   270.0   202.4156 4.811543   202.4156 4.811543 
1 1 1    0    3   14 o 187.1552 2.065305   193.7150   270.0   350.5811 7.728541   350.5811 7.728541 
1 1 1    0    3   15 o 60.98813 1.332737   101.6386    90.0   37.25939 1.623896   37.25939 1.623896 
1 1 1    0    3   16 o 65.03139 1.435072   97.47856    90.0   42.37165 1.864473   42.37165 1.864473 
1 1 1    0    3   17 o 5.637294 3.775394   24.24233   270.0 -0.3307936 1.142741 -0.3307936 1.142741 
1 1 1    0    3   18 o 115.1448 1.449998   102.8057   270.0   132.7384 3.338008   132.7384 3.338008 
1 1 1    0    3   19 o 3.860723 2.859816   20.44125    90.0  -3.428224 1.383319  -3.428224 1.383319 
1 1 1    0    3   20 o 10.46686 5.279700   10.23496    90.0   1.653968 1.353247   1.653968 1.353247 
1 1 1    0    3   21 x        ?      ?   70.31694   270.0          ?        ?          ?        ? 
1 1 1    0    3   22 x        ?      ?   5.852820    90.0          ?        ?          ?        ? 
1 1 1    0    3   23 o 11.62866 5.706606   5.296098   270.0   2.165194 1.563751   2.165194 1.563751 
1 1 1    0    3   24 o 11.57121 5.877759   12.87667    90.0   2.255411 1.684040   2.255411 1.684040 
1 1 1    0    3   25 o 19.49254 6.889444   26.66867   270.0   5.894140 2.435844   5.894140 2.435844 
1 1 1    0    4    0 f 420.5420 5.229053   1844.162   180.0   1770.618 43.96547   1770.618 43.96547 
1 1 1    0    4    1 o 50.15404 0.7198470   119.7840   180.0   25.17038 0.7217315   25.17038 0.7217315 
1 1 1    0    4    2 o 117.5187 1.484708   1049.831     0.0   138.1815 3.488369   138.1815 3.488369 
1 1 1    0    4    3 o 189.2043 2.520203   569.3906     0.0   358.2194 9.532870   358.2194 9.532870 
1 1 1    0    4    4 o 123.9941 1.771270   453.5210     0.0   153.8491 4.390533   153.8491 4.390533 
1 1 1    0    4    5 f 35.83633 0.9665811   160.4802   180.0   12.87088 0.6916593   12.87088 0.6916593 
1 1 1    0    4    6 o 139.7020 1.981277   4.193282     0.0   195.3186 5.533275   195.3186 5.533275 
1 1 1    0    4    7 o 353.6946 4.188696   438.1693     0.0   1252.294 29.62106   1252.294 29.62106 
1 1 1    0    4    8 o 320.5566 3.260734   394.8571     0.0   1028.106 20.90014   1028.106 20.90014 
1 1 1    0    4    9 o 371.8484 4.538438   490.8927   180.0   1383.860 33.74094   1383.860 33.74094 
1 1 1    0    4   10 o 132.1836 2.060020   155.0449     0.0   174.8695 5.443058   174.8695 5.443058 
1 1 1    0    4   11 o 81.14638 1.483472   34.36631     0.0   65.91814 2.405771   65.91814 2.405771 
1 1 1    0    4   12 o 54.17765 1.361819   1.481385     0.0   29.41056 1.473535   29.41056 1.473535 
1 1 1    0    4   13 o 106.1403 1.445555   54.14382   180.0   112.7405 3.067359   112.7405 3.067359 
1 1 1    0    4   14 o 34.16803 1.904684   26.47121   180.0   11.78828 1.293102   11.78828 1.293102 
1 1 1    0    4   15 o 248.7945 2.575180   293.2712     0.0   619.8470 12.81073   619.8470 12.81073 
1 1 1    0    4   16 o 19.48425 3.133283   1.789934     0.0   4.029667 1.142741   4.029667 1.142741 
1 1 1    0    4   17 o 7.735703 4.748058  0.3426569   180.0  0.5412986 1.383319  0.5412986 1.383319 
1 1 1    0    4   18 o 17.80241 4.079080   32.90858     0.0   3.638730 1.263030   3.638730 1.263030 
1 1 1    0    4   19 o 78.80109 1.432135   53.80391   180.0   62.21926 2.255411   62.21926 2.255411 
1 1 1    0    4   20 o 52.04268 1.941641   57.80760     0.0   27.27543 2.014834   27.27543 2.014834 
1 1 1    0    4   21 o 23.95791 5.066602   25.86533     0.0   6.585800 2.135122   6.585800 2.135122 
1 1 1    0    4   22 o 45.10149 2.076411   59.56176     0.0   20.62949 1.864473   20.62949 1.864473 
1 1 1    0    4   23 o 5.998327 4.126123   1.586757   180.0 -0.7518036 1.533679 -0.7518036 1.533679 
1 1 1    0    4   24 f 11.96228 7.012610   7.022266     0.0   2.495988 2.766637   2.495988 2.766637 
1 1 1    0    4   25 o 5.773672 4.180565   18.68606     0.0  -3.037287 2.315555  -3.037287 2.315555 
1 1 1    0    5    1 o 272.5079 2.472371   507.6966   270.0   742.9323 13.47232   742.9323 13.47232 
1 1 1    0    5    2 o 17.98409 0.6708961   235.6190   270.0   3.247792 0.2405772   3.247792 0.2405772 
1 1 1    0    5    3 o 15.24886 1.300001   116.8345    90.0   2.375700 0.3909379   2.375700 0.3909379 
1 1 1    0    5    4 o 276.9258 3.449021   617.9631   270.0   767.4412 19.09581   767.4412 19.09581 
1 1 1    0    5    5 o 94.48213 1.496775   108.7782   270.0   89.34435 2.826782   89.34435 2.826782 
1 1 1    0    5    6 o 148.7340 2.093569   13.15420   270.0   221.3911 6.224934   221.3911 6.224934 
1 1 1    0    5    7 o 289.4185 3.523565   190.0148    90.0   838.3513 20.38891   838.3513 20.38891 
1 1 1    0    5    8 o 435.4913 5.070059   907.3464    90.0   1898.214 44.14591   1898.214 44.14591 
1 1 1    0    5    9 o 273.5997 3.540525   334.5936    90.0   749.1272 19.36646   749.1272 19.36646 
1 1 1    0    5   10 o 122.7094 1.593544   171.9411    90.0   150.6614 3.909379   150.6614 3.909379 
1 1 1    0    5   11 o 399.3541 3.931617   477.0115   270.0   1596.169 31.39532   1596.169 31.39532 
1 1 1    0    5   12 o 241.2003 2.544048   341.7540   270.0   582.1667 12.26943   582.1667 12.26943 
1 1 1    0    5   13 o 150.1839 1.842789   182.7971    90.0   225.7215 5.533275   225.7215 5.533275 
1 1 1    0    5   14 o 44.70641 1.483432   35.58595    90.0   20.05812 1.323174   20.05812 1.323174 
1 1 1    0    5   15 o 78.46470 1.419088   80.77699   270.0   61.64790 2.225339   61.64790 2.225339 
1 1 1    0    5   16 o 7.309365 4.457499   50.93061    90.0  0.5112265 1.202886  0.5112265 1.202886 
1 1 1    0    5   17 o 15.83197 4.293020   18.70929    90.0   3.007215 1.172814   3.007215 1.172814 
1 1 1    0    5   18 o 35.88706 1.811429   40.36171    90.0   12.99117 1.293102   12.99117 1.293102 
1 1 1    0    5   19 o 20.15342 3.714000   4.465983    90.0   4.450677 1.353247   4.450677 1.353247 
1 1 1    0    5   20 f 27.39526 2.337880   15.96301   270.0   7.698469 1.263030   7.698469 1.263030 
1 1 1    0    5   21 o 46.67374 2.135803   52.43009    90.0   22.04288 1.984761   22.04288 1.984761 
1 1 1    0    5   22 o 48.34249 2.218347   59.45374    90.0   23.72692 2.135122   23.72692 2.135122 
1 1 1    0    5   23 o 4.741121 3.511430   9.654597    90.0  -4.991976 2.105050  -4.991976 2.105050 
1 1 1    0    5   24 o 25.96006 5.461254   31.86981   270.0   8.209695 2.495988   8.209695 2.495988 
1 1 1    0    5   25 o 25.30705 3.972071   30.26485   270.0   7.307531 1.894545   7.307531 1.894545 
1 1 1    0    6    0 o 774.8589 12.85591   1883.650   180.0   6021.917 199.1077   6021.917 199.1077 
1 1 1    0    6    1 o 421.6665 3.677039   228.1213   180.0   1779.008 31.00438   1779.008 31.00438 
1 1 1    0    6    2 o 487.4606 4.127822   825.7620   180.0   2377.504 40.23653   2377.504 40.23653 
1 1 1    0    6    3 o 54.51095 0.9384633   329.4125     0.0   29.74135 1.022453   29.74135 1.022453 
1 1 1    0    6    4 o 156.5329 2.229535   81.85396   180.0   245.2083 6.976738   245.2083 6.976738 
1 1 1    0    6    5 o 385.1219 4.565493   797.6998   180.0   1485.233 35.15434   1485.233 35.15434 
1 1 1    0    6    6 o 60.93023 1.185522   51.77821     0.0   37.16917 1.443463   37.16917 1.443463 
1 1 1    0    6    7 o 252.3971 3.128664   394.4192     0.0   637.5295 15.78788   637.5295 15.78788 
1 1 1    0    6    8 o 150.1438 2.234329   199.3395   180.0   225.6012 6.706088   225.6012 6.706088 
1 1 1    0    6    9 o 518.3862 6.078536   665.0450   180.0   2690.405 63.00114   2690.405 63.00114 
1 1 1    0    6   10 o 443.3752 4.239964   523.4979   180.0   1967.260 37.59018   1967.260 37.59018 
1 1 1    0    6   11 o 114.1909 1.580777   102.4539   180.0   130.4830 3.608657   130.4830 3.608657 
1 1 1    0    6   12 o 86.49104 1.461234   108.8303     0.0   74.87964 2.526060   74.87964 2.526060 
1 1 1    0    6   13 o 58.31996 1.342246   33.64695   180.0   34.07174 1.563751   34.07174 1.563751 
1 1 1    0    6   14 o 212.8024 2.367682   206.0086     0.0   453.3376 10.07417   453.3376 10.07417 
1 1 1    0    6   15 o 27.46900 2.217724   4.815609     0.0   7.698469 1.202886   7.698469 1.202886 
1 1 1    0    6   16 o 7.325455 4.409011   13.47425   180.0  0.5713707 1.142741  0.5713707 1.142741 
1 1 1    0    6   17 o 26.36514 2.553385   33.07922   180.0   7.157170 1.323174   7.157170 1.323174 
1 1 1    0    6   18 o 26.12274 2.578493   32.84198     0.0   7.036882 1.323174   7.036882 1.323174 
1 1 1    0    6   19 o 44.33158 1.838373   31.60431   180.0   19.78747 1.623896   19.78747 1.623896 
1 1 1    0    6   20 o 20.20836 3.373117   18.58261   180.0   4.390533 1.263030   4.390533 1.263030 
1 1 1    0    6   21 o 6.505960 4.518528   14.02750   180.0  -1.263030 1.924617  -1.263030 1.924617 
1 1 1    0    6   22 o 31.29907 2.282146   43.96450   180.0   10.04410 1.413391   10.04410 1.413391 
1 1 1    0    6   23 o 8.992867 5.760946   13.41733   180.0  0.6315150 2.255411  0.6315150 2.255411 
1 1 1    0    6   24 o 21.02683 5.639086   34.51765   180.0   5.713707 2.044906   5.713707 2.044906 
1 1 1    0    6   25 o 19.68249 6.606932   12.60875   180.0   5.833996 2.315555   5.833996 2.315555 
1 1 1    0    7    1 o 274.8535 2.577150   709.8585    90.0   755.7431 14.16398   755.7431 14.16398 
1 1 1    0    7    2 o 226.5533 2.177348   342.9404    90.0   513.4518 9.863664   513.4518 9.863664 
1 1 1    0    7    3 o 10.72399 1.825484   65.89248    90.0   1.232958 0.3608657   1.232958 0.3608657 
1 1 1    0    7    4 o 55.57242 1.001826   332.0568   270.0   30.91417 1.112669   30.91417 1.112669 
1 1 1    0    7    5 o 217.2247 2.839065   221.3040    90.0   472.2830 12.32958   472.2830 12.32958 
1 1 1    0    7    6 o 56.17875 1.205648   131.9062   270.0   31.60582 1.353247   31.60582 1.353247 
1 1 1    0    7    7 o 426.5398 5.021343   445.7008    90.0   1821.349 42.82273   1821.349 42.82273 
1 1 1    0    7    8 x        ?      ?   1165.744    90.0          ?        ?          ?        ? 
1 1 1    0    7    9 f 73.17547 1.522017   130.0395   270.0   53.61863 2.225339   53.61863 2.225339 
1 1 1    0    7   10 o 45.61400 1.752707   31.46054    90.0   20.90014 1.593824   20.90014 1.593824 
1 1 1    0    7   11 o 108.6914 1.466973   111.5481    90.0   118.2136 3.187647   118.2136 3.187647 
1 1 1    0    7   12 o 42.24521 1.570798   75.22038    90.0   17.92300 1.323174   17.92300 1.323174 
1 1 1    0    7   13 o 188.2938 2.100755   235.9582    90.0   354.8212 7.908974   354.8212 7.908974 
1 1 1    0    7   14 o 91.84117 1.523517   127.7237    90.0   84.44258 2.796710   84.44258 2.796710 
1 1 1    0    7   15 o 72.95807 1.485234   60.28110   270.0   53.31791 2.165194   53.31791 2.165194 
1 1 1    0    7   16 o 52.14095 1.560297   48.78959   270.0   27.27543 1.623896   27.27543 1.623896 
1 1 1    0    7   17 o 140.2578 1.823144   143.0672   270.0   197.0026 5.112265   197.0026 5.112265 
1 1 1    0    7   18 o 4.849676 3.459451   13.42366   270.0  -1.623896 1.353247  -1.623896 1.353247 
1 1 1    0    7   19 o 10.32309 5.308407   10.93160   270.0   1.593824 1.383319   1.593824 1.383319 
1 1 1    0    7   20 o 37.68168 1.885470   46.73986   270.0   14.34441 1.413391   14.34441 1.413391 
1 1 1    0    7   21 o 17.02070 5.670460   3.651672    90.0   3.819162 1.714112   3.819162 1.714112 
1 1 1    0    7   22 o 9.280897 5.561847   12.06314    90.0   1.082597 1.804329   1.082597 1.804329 
1 1 1    0    7   23 f 5.196696 3.749792   7.924694   270.0  -2.345627 1.744184  -2.345627 1.744184 
1 1 1    0    7   24 o 8.970643 5.767115   1.947750    90.0  0.7518036 2.285483  0.7518036 2.285483 
1 1 1    0    7   25 o 12.09405 7.269460   9.722451    90.0   3.097431 3.097431   3.097431 3.097431 
1 1 1    0    8    0 o 593.8427 7.061444   833.3892     0.0   3529.628 83.84113   3529.628 83.84113 
1 1 1    0    8    1 o 595.9948 5.195442   260.2560   180.0   3554.708 61.91854   3554.708 61.91854 
1 1 1    0    8    2 o 79.10654 1.007757   2.272894     0.0   62.61020 1.593824   62.61020 1.593824 
1 1 1    0    8    3 o 106.3825 1.215877   309.1317   180.0   113.2216 2.586205   113.2216 2.586205 
1 1 1    0    8    4 o 269.8335 2.881644   35.11399     0.0   728.6180 15.54730   728.6180 15.54730 
1 1 1    0    8    5 o 90.41349 1.547635   369.5967   180.0   81.82631 2.796710   81.82631 2.796710 
1 1 1    0    8    6 f 58.13994 1.372377   85.72163   180.0   33.86123 1.593824   33.86123 1.593824 
1 1 1    0    8    7 o 255.1218 3.219100   149.9629     0.0   651.3326 16.41939   651.3326 16.41939 
1 1 1    0    8    8 o 603.6815 6.811600   769.9276     0.0   3648.653 82.21724   3648.653 82.21724 
1 1 1    0    8    9 o 383.1862 4.682852   466.6829   180.0   1469.686 35.87607   1469.686 35.87607 
1 1 1    0    8   10 o 69.74159 1.575646   132.0340     0.0   48.71687 2.195267   48.71687 2.195267 
1 1 1    0    8   11 o 14.74147 4.931927   17.23405   180.0   2.796710 1.293102   2.796710 1.293102 
1 1 1    0    8   12 o 64.16279 1.360549   86.94412   180.0   41.22891 1.744184   41.22891 1.744184 
1 1 1    0    8   13 o 156.1665 1.878114   185.1304     0.0   244.0655 5.864068   244.0655 5.864068 
1 1 1    0    8   14 o 67.67242 1.334291   82.66736     0.0   45.86002 1.804329   45.86002 1.804329 
1 1 1    0    8   15 o 22.96630 2.542023   4.533895   180.0   5.473131 1.142741   5.473131 1.142741 
1 1 1    0    8   16 o 204.9566 2.377654   240.1969     0.0   420.7995 9.743376   420.7995 9.743376 
1 1 1    0    8   17 o 68.60198 1.448014   68.52640   180.0   47.15312 1.984761   47.15312 1.984761 
1 1 1    0    8   18 o 12.74186 5.044506   13.83574     0.0   2.255411 1.232958   2.255411 1.232958 
1 1 1    0    8   19 o 60.07586 1.503798   71.69450   180.0   36.20686 1.804329   36.20686 1.804329 
1 1 1    0    8   20 o 10.73375 5.350797   25.58095     0.0   1.744184 1.383319   1.744184 1.383319 
1 1 1    0    8   21 o 34.79678 2.178144   60.87051     0.0   12.32958 1.503607   12.32958 1.503607 
1 1 1    0    8   22 o 19.72231 4.941393   24.21322   180.0   4.691255 1.684040   4.691255 1.684040 
1 1 1    0    8   23 o 11.20205 5.669859   8.260828   180.0   2.044906 1.563751   2.044906 1.563751 
1 1 1    0    8   24 o 49.38385 2.201619   50.95432     0.0   25.05010 2.165194   25.05010 2.165194 
1 1 1    0    9    1 o 75.58418 1.094637   165.1776    90.0   57.16715 1.653968   57.16715 1.653968 
1 1 1    0    9    2 o 90.79895 1.159606   12.31373   270.0   82.48789 2.105050   82.48789 2.105050 
1 1 1    0    9    3 o 198.9877 1.980187   275.1436   270.0   396.1404 7.878902   396.1404 7.878902 
1 1 1    0    9    4 o 114.9159 1.492187   210.2744    90.0   132.1370 3.428224   132.1370 3.428224 
1 1 1    0    9    5 o 291.4599 3.049648   588.8554   270.0   850.0794 17.77264   850.0794 17.77264 
1 1 1    0    9    6 o 335.4083 4.184021   518.5215   270.0   1126.142 28.05731   1126.142 28.05731 
1 1 1    0    9    7 o 203.8596 2.722722   418.0912   270.0   415.8677 11.09662   415.8677 11.09662 
1 1 1    0    9    8 o 324.9876 4.026580   289.8450   270.0   1056.976 26.16277   1056.976 26.16277 
1 1 1    0    9    9 o 372.1164 4.365294   567.0528    90.0   1385.875 32.47792   1385.875 32.47792 
1 1 1    0    9   10 o 155.8664 2.248745   204.8248   270.0   243.1333 7.006810   243.1333 7.006810 
1 1 1    0    9   11 o 103.1258 1.736158   210.7845   270.0   106.4554 3.578585   106.4554 3.578585 
1 1 1    0    9   12 o 110.6126 1.849867   129.2688   270.0   122.4838 4.089812   122.4838 4.089812 
1 1 1    0    9   13 o 81.72160 1.343950   77.93190   270.0   66.85038 2.195267   66.85038 2.195267 
1 1 1    0    9   14 o 89.64098 1.443372   89.93134    90.0   80.44299 2.586205   80.44299 2.586205 
1 1 1    0    9   15 o 116.5590 1.471121   137.7911    90.0   135.9862 3.428224   135.9862 3.428224 
1 1 1    0    9   16 o 46.68258 1.679626   37.95218    90.0   21.89252 1.563751   21.89252 1.563751 
1 1 1    0    9   17 o 138.6854 1.865556   143.6130    90.0   192.6422 5.172409   192.6422 5.172409 
1 1 1    0    9   18 o 33.91542 2.191111   34.19324   270.0   11.66799 1.473535   11.66799 1.473535 
1 1 1    0    9   19 o 6.803002 4.378589   3.502958    90.0  0.1202886 1.323174  0.1202886 1.323174 
1 1 1    0    9   20 o 42.37112 1.781132   43.91444   270.0   18.10343 1.503607   18.10343 1.503607 
1 1 1    0    9   21 o 46.70405 1.808783   40.46037    90.0   22.01281 1.684040   22.01281 1.684040 
1 1 1    0    9   22 o 28.67524 3.160613   39.08639    90.0   8.690849 1.774257   8.690849 1.774257 
1 1 1    0    9   23 o 6.582594 4.463643   2.809103    90.0 -0.5112265 1.684040 -0.5112265 1.684040 
1 1 1    0    9   24 f 9.297588 5.718593   7.250178    90.0   1.202886 2.014834   1.202886 2.014834 
1 1 1    0   10    0 o 768.1305 9.565662   1295.816   180.0   5911.101 146.9024   5911.101 146.9024 
1 1 1    0   10    1 o 65.02343 0.9948569   456.5095     0.0   42.31151 1.293102   42.31151 1.293102 
1 1 1    0   10    2 o 44.62529 0.8768004   176.4760     0.0   19.93783 0.7818757   19.93783 0.7818757 
1 1 1    0   10    3 o 539.1530 4.602327   595.7146   180.0   2910.352 49.61904   2910.352 49.61904 
1 1 1    0   10    4 o 256.9055 2.745650   110.9748   180.0   660.4445 14.10384   660.4445 14.10384 
1 1 1    0   10    5 o 151.7889 1.872856   304.5496     0.0   230.5331 5.683635   230.5331 5.683635 
1 1 1    0   10    6 f 17.71927 1.905701   165.4834   180.0   3.247792 0.6615872   3.247792 0.6615872 
1 1 1    0   10    7 o 242.6233 3.124596   313.0327   180.0   589.0532 15.15636   589.0532 15.15636 
1 1 1    0   10    8 o 51.40563 1.494530   97.43103   180.0   26.49356 1.533679   26.49356 1.533679 
1 1 1    0   10    9 o 380.4445 4.633564   577.0000   180.0   1448.786 35.24455   1448.786 35.24455 
1 1 1    0   10   10 o 51.39198 1.907474   97.27572   180.0   26.52363 1.954689   26.52363 1.954689 
1 1 1    0   10   11 o 106.2665 1.798125   80.52231   180.0   113.0412 3.819162   113.0412 3.819162 
1 1 1    0   10   12 o 114.1946 2.042353   119.9248   180.0   130.5733 4.661182   130.5733 4.661182 
1 1 1    0   10   13 o 37.24096 1.908251   39.49908     0.0   13.98355 1.413391   13.98355 1.413391 
1 1 1    0   10   14 o 84.72925 1.402796   80.31431     0.0   71.87243 2.375700   71.87243 2.375700 
1 1 1    0   10   15 o 80.33434 1.442237   99.15510   180.0   64.62504 2.315555   64.62504 2.315555 
1 1 1    0   10   16 o 199.5101 2.231429   246.4853   180.0   398.7567 8.901355   398.7567 8.901355 
1 1 1    0   10   17 o 13.70348 5.324004   12.78745     0.0   2.586205 1.383319   2.586205 1.383319 
1 1 1    0   10   18 o 163.1560 2.083524   156.1838   180.0   266.8301 6.796305   266.8301 6.796305 
1 1 1    0   10   19 o 14.09882 5.279213   29.85429   180.0   2.706493 1.383319   2.706493 1.383319 
1 1 1    0   10   20 o 68.06589 1.548113   93.05547   180.0   46.52161 2.105050   46.52161 2.105050 
1 1 1    0   10   21 f 8.951390 5.142727   13.00158   180.0   1.112669 1.443463   1.112669 1.443463 
1 1 1    0   10   22 o 6.438471 4.387148   7.316430   180.0 -0.6315150 1.653968 -0.6315150 1.653968 
1 1 1    0   10   23 o 19.81727 5.693885   12.19076     0.0   5.082192 1.954689   5.082192 1.954689 
1 1 1    0   10   24 o 43.95533 2.584164   48.18085   180.0   20.11827 2.255411   20.11827 2.255411 
1 1 1    0   11    1 o 67.93719 1.062933   161.3113    90.0   46.19081 1.443463   46.19081 1.443463 
1 1 1    0   11    2 o 169.8699 1.761878   174.2110    90.0   288.6926 5.984357   288.6926 5.984357 
1 1 1    0   11    3 o 258.2606 2.410802   16.68545   270.0   667.3310 12.44987   667.3310 12.44987 
1 1 1    0   11    4 o 74.60449 1.048491   47.68701   270.0   55.69361 1.563751   55.69361 1.563751 
1 1 1    0   11    5 o 58.79777 1.151749   36.98059   270.0   34.61304 1.353247   34.61304 1.353247 
1 1 1    0   11    6 o 264.8616 2.878979   334.5538   270.0   701.8839 15.24658   701.8839 15.24658 
1 1 1    0   11    7 o 529.1052 5.144736   482.3396   270.0   2801.611 54.43058   2801.611 54.43058 
1 1 1    0   11    8 o 79.11640 1.559762   50.69902    90.0   62.67035 2.465916   62.67035 2.465916 
1 1 1    0   11    9 f 413.1942 4.946970   554.8134   270.0   1709.180 40.86804   1709.180 40.86804 
1 1 1    0   11   10 o 45.70236 2.081972   26.27057    90.0   21.02043 1.894545   21.02043 1.894545 
1 1 1    0   11   11 o 99.20228 1.729070   234.5614    90.0   98.51635 3.428224   98.51635 3.428224 
1 1 1    0   11   12 o 58.82436 1.741511   107.2259    90.0   34.70325 2.044906   34.70325 2.044906 
1 1 1    0   11   13 o 144.9462 2.148382   172.8423   270.0   210.3546 6.224934   210.3546 6.224934 
1 1 1    0   11   14 o 10.83637 5.407556   11.43109    90.0   1.744184 1.413391   1.744184 1.413391 
1 1 1    0   11   15 o 114.4949 1.576572   84.58961    90.0   131.2348 3.608657   131.2348 3.608657 
1 1 1    0   11   16 o 71.61871 1.492060   89.06738    90.0   51.39330 2.135122   51.39330 2.135122 
1 1 1    0   11   17 o 125.8478 1.757097   134.4956    90.0   158.6306 4.420605   158.6306 4.420605 
1 1 1    0   11   18 o 7.069354 4.450786   15.45926   270.0  0.3007214 1.293102  0.3007214 1.293102 
1 1 1    0   11   19 o 13.43605 5.485169   23.03124   270.0   2.556132 1.443463   2.556132 1.443463 
1 1 1    0   11   20 o 39.46014 1.992216   21.24530    90.0   15.75780 1.563751   15.75780 1.563751 
1 1 1    0   11   21 o 105.0139 1.676181   112.9097   270.0   110.8459 3.518441   110.8459 3.518441 
1 1 1    0   11   22 o 15.47103 5.307964   23.43752   270.0   3.247792 1.473535   3.247792 1.473535 
1 1 1    0   11   23 o 13.58715 6.075130   26.80636   270.0   2.916998 1.744184   2.916998 1.744184 
1 1 1    0   11   24 o 8.906742 5.444784   20.00712   270.0   1.142741 1.804329   1.142741 1.804329 
1 1 1    0   12    0 o 144.1041 2.390897   299.0771   180.0   207.8587 6.886521   207.8587 6.886521 
1 1 1    0   12    1 o 41.18870 0.9136334   121.3529   180.0   16.99076 0.7518036   16.99076 0.7518036 
1 1 1    0   12    2 o 238.5555 2.338905   187.1449   180.0   569.3860 11.15676   569.3860 11.15676 
1 1 1    0   12    3 o 75.84357 1.051183   214.4484     0.0   57.55808 1.593824   57.55808 1.593824 
1 1 1    0   12    4 o 59.56790 1.010326   66.00972     0.0   35.51520 1.202886   35.51520 1.202886 
1 1 1    0   12    5 o 202.2616 2.305204   87.68044   180.0   409.3120 9.322365   409.3120 9.322365 
1 1 1    0   12    6 o 85.36238 1.357076   89.47066     0.0   72.92495 2.315555   72.92495 2.315555 
1 1 1    0   12    7 o 209.1110 2.366346   116.4031     0.0   437.4896 9.893736   437.4896 9.893736 
1 1 1    0   12    8 o 262.7805 2.855993   272.6538   180.0   690.9075 15.00600   690.9075 15.00600 
1 1 1    0   12    9 o 320.2443 3.945301   348.3469   180.0   1026.513 25.26060   1026.513 25.26060 
1 1 1    0   12   10 o 131.3771 2.084158   269.8988     0.0   172.7645 5.473131   172.7645 5.473131 
1 1 1    0   12   11 o 213.3282 2.876890   198.6237   180.0   455.5629 12.26943   455.5629 12.26943 
1 1 1    0   12   12 o 37.50627 2.016765   17.39276   180.0   14.19405 1.503607   14.19405 1.503607 
1 1 1    0   12   13 o 108.9804 1.932945   96.27123   180.0   118.9353 4.210100   118.9353 4.210100 
1 1 1    0   12   14 o 112.3141 2.049814   130.2843   180.0   126.3632 4.601038   126.3632 4.601038 
1 1 1    0   12   15 o 92.83823 1.523340   92.94693     0.0   86.30705 2.826782   86.30705 2.826782 
1 1 1    0   12   16 o 10.36884 5.358265   21.79834     0.0   1.593824 1.413391   1.593824 1.413391 
1 1 1    0   12   17 o 22.22926 3.123562   80.39825   180.0   5.112265 1.353247   5.112265 1.353247 
1 1 1    0   12   18 o 5.634297 3.931702   15.65703   180.0  -1.263030 1.533679  -1.263030 1.533679 
1 1 1    0   12   19 o 80.49416 1.458086   109.9180     0.0   64.95583 2.345627   64.95583 2.345627 
1 1 1    0   12   20 o 32.18135 2.506241   55.70453     0.0   10.61547 1.593824   10.61547 1.593824 
1 1 1    0   12   21 o 48.02504 1.758437   48.43322   180.0   23.27584 1.684040   23.27584 1.684040 
1 1 1    0   12   22 o 8.902514 5.063322  0.4383873   180.0   1.172814 1.383319   1.172814 1.383319 
1 1 1    0   12   23 o 45.44876 2.060272   42.09643   180.0   21.08057 1.864473   21.08057 1.864473 
1 1 1    0   12   24 o 7.642389 5.006644   11.58836     0.0  0.3307936 1.834401  0.3307936 1.834401 
1 1 1    0   13    1 o 175.0679 1.932988   114.1137    90.0   306.6457 6.766232   306.6457 6.766232 
1 1 1    0   13    2 o 62.59042 1.105827   45.76757    90.0   39.21407 1.383319   39.21407 1.383319 
1 1 1    0   13    3 o 298.3393 2.757367   326.1336    90.0   890.5264 16.44946   890.5264 16.44946 
1 1 1    0   13    4 o 323.3322 2.902342   443.8184    90.0   1045.939 18.76502   1045.939 18.76502 
1 1 1    0   13    5 o 331.6602 3.496260   477.5059   270.0   1100.610 23.18562   1100.610 23.18562 
1 1 1    0   13    6 o 157.6944 2.031699   221.0415    90.0   248.8169 6.405366   248.8169 6.405366 
1 1 1    0   13    7 o 381.0248 3.883985   391.3308    90.0   1452.725 29.59099   1452.725 29.59099 
1 1 1    0   13    8 o 5.306055 3.680865   4.041500   270.0 -0.8720922 1.263030 -0.8720922 1.263030 
1 1 1    0   13    9 o 30.52424 2.038147   68.25108   270.0   9.442654 1.232958   9.442654 1.232958 
1 1 1    0   13   10 o 128.5794 2.047611   131.4232   270.0   165.4870 5.262625   165.4870 5.262625 
1 1 1    0   13   11 o 278.6028 3.595715   282.1642    90.0   777.3048 20.02805   777.3048 20.02805 
1 1 1    0   13   12 o 517.0522 9.023967   558.1640    90.0   2696.810 93.25372   2696.810 93.25372 
1 1 1    0   13   13 f 93.42124 1.852540   92.11301    90.0   87.41973 3.458297   87.41973 3.458297 
1 1 1    0   13   14 o 158.8271 2.292070   131.6084    90.0   252.6962 7.277459   252.6962 7.277459 
1 1 1    0   13   15 o 13.84354 5.719225   28.92466    90.0   2.706493 1.563751   2.706493 1.563751 
1 1 1    0   13   16 o 58.11415 1.502881   58.81212    90.0   33.86123 1.744184   33.86123 1.744184 
1 1 1    0   13   17 o 30.22894 2.366320   7.269394    90.0   9.322365 1.413391   9.322365 1.413391 
1 1 1    0   13   18 o 30.80320 2.725226   13.01563   270.0   9.743376 1.653968   9.743376 1.653968 
1 1 1    0   13   19 o 10.29064 5.304697   6.468295   270.0   1.593824 1.383319   1.593824 1.383319 
1 1 1    0   13   20 o 21.63976 3.389845   20.27006    90.0   4.991976 1.383319   4.991976 1.383319 
1 1 1    0   13   21 o 45.09052 2.009366   50.07802    90.0   20.59942 1.804329   20.59942 1.804329 
1 1 1    0   13   22 o 6.716843 4.398033  0.7704702    90.0       0.03 1.413391       0.03 1.413391 
1 1 1    0   13   23 o 11.50548 5.603998   2.677805    90.0   2.165194 1.503607   2.165194 1.503607 
1 1 1    0   13   24 o 9.677883 5.614643   15.76543   270.0   1.623896 1.744184   1.623896 1.744184 
1 1 1    0   14    0 o 227.5089 3.385488   443.3048     0.0   518.0528 15.39694   518.0528 15.39694 
1 1 1    0   14    1 o 63.02439 1.050384   224.7751     0.0   39.75537 1.323174   39.75537 1.323174 
1 1 1    0   14    2 o 292.4687 2.756173   217.6453   180.0   855.8231 16.11867   855.8231 16.11867 
1 1 1    0   14    3 o 170.7818 1.814137   207.5093   180.0   291.7900 6.194862   291.7900 6.194862 
1 1 1    0   14    4 o 331.2693 2.928122   425.3492   180.0   1097.844 19.39653   1097.844 19.39653 
1 1 1    0   14    5 o 507.8874 4.269738   543.5744   180.0   2580.852 43.36403   2580.852 43.36403 
1 1 1    0   14    6 o 618.3779 5.904974   624.8079     0.0   3827.583 73.01517   3827.583 73.01517 
1 1 1    0   14    7 o 65.52578 1.470242   174.5777   180.0   43.00317 1.924617   43.00317 1.924617 
1 1 1    0   14    8 o 309.2221 3.205192   284.5760     0.0   956.7754 19.81754   956.7754 19.81754 
1 1 1    0   14    9 o 65.95638 1.506348   96.75529   180.0   43.57454 1.984761   43.57454 1.984761 
1 1 1    0   14   10 o 79.95751 1.656431   146.7010     0.0   64.02360 2.646349   64.02360 2.646349 
1 1 1    0   14   11 o 302.4416 5.806589   346.1919     0.0   918.3432 35.09419   918.3432 35.09419 
1 1 1    0   14   12 o 56.58731 3.020734   53.96937     0.0   32.32756 3.398152   32.32756 3.398152 
1 1 1    0   14   13 o 77.73521 1.645770   75.03367   180.0   60.53523 2.556132   60.53523 2.556132 
1 1 1    0   14   14 o 171.5000 2.675511   217.9298     0.0   294.7672 9.172004   294.7672 9.172004 
1 1 1    0   14   15 o 24.38744 3.041266   25.35047   180.0   6.014429 1.503607   6.014429 1.503607 
1 1 1    0   14   16 o 45.62758 2.185669   29.28485     0.0   20.99036 1.984761   20.99036 1.984761 
1 1 1    0   14   17 o 56.03488 1.666924   59.56145     0.0   31.51561 1.864473   31.51561 1.864473 
1 1 1    0   14   18 o 27.01046 2.897890   33.67768     0.0   7.578181 1.533679   7.578181 1.533679 
1 1 1    0   14   19 o 6.106594 4.082813   6.847941     0.0 -0.3307936 1.323174 -0.3307936 1.323174 
1 1 1    0   14   20 o 10.30479 5.350934   12.70752   180.0   1.623896 1.413391   1.623896 1.413391 
1 1 1    0   14   21 o 50.21901 1.922353   50.07906     0.0   25.50118 1.924617   25.50118 1.924617 
1 1 1    0   14   22 o 18.19825 5.067475   27.61360   180.0   4.180028 1.593824   4.180028 1.593824 
1 1 1    0   14   23 o 19.63917 4.964849   21.74864     0.0   4.811543 1.684040   4.811543 1.684040 
1 1 1    0   14   24 o 18.82117 5.852217   5.602357     0.0   4.991976 1.924617   4.991976 1.924617 
1 1 1    0   15    1 o 101.5642 1.288456   74.02232    90.0   103.2076 2.616277   103.2076 2.616277 
1 1 1    0   15    2 o 315.0050 2.902708   188.8049   270.0   992.7416 18.28386   992.7416 18.28386 
1 1 1    0   15    3 o 608.2531 5.100561   700.2464   270.0   3702.422 62.03883   3702.422 62.03883 
1 1 1    0   15    4 o 263.4869 2.499984   268.1711    90.0   694.5162 13.17160   694.5162 13.17160 
1 1 1    0   15    5 o 85.24784 1.164599   101.8488   270.0   72.71445 1.984761   72.71445 1.984761 
1 1 1    0   15    6 o 3.642115 2.645966   83.17199   270.0  -1.714112 0.9623086  -1.714112 0.9623086 
1 1 1    0   15    7 o 47.54021 1.553419   29.98011    90.0   22.67440 1.473535   22.67440 1.473535 
1 1 1    0   15    8 o 291.4246 3.029366   214.8931    90.0   849.8087 17.65235   849.8087 17.65235 
1 1 1    0   15    9 o 238.0857 2.653209   306.7353    90.0   567.2509 12.63030   567.2509 12.63030 
1 1 1    0   15   10 o 418.7362 4.137534   520.4156   270.0   1755.732 34.64311   1755.732 34.64311 
1 1 1    0   15   11 o 19.96308 4.087392   94.21301    90.0   4.450677 1.443463   4.450677 1.443463 
1 1 1    0   15   12 o 7.732571 4.859979   29.13144    90.0  0.3608657 1.533679  0.3608657 1.533679 
1 1 1    0   15   13 o 6.687435 4.438628   11.07679   270.0 -0.2706493 1.503607 -0.2706493 1.503607 
1 1 1    0   15   14 o 95.68279 2.013442   106.4802   270.0   91.75011 3.849235   91.75011 3.849235 
1 1 1    0   15   15 o 77.27591 1.987594   65.33624    90.0   59.90371 3.067359   59.90371 3.067359 
1 1 1    0   15   16 o 22.29609 3.709059   53.65714   270.0   5.322770 1.533679   5.322770 1.533679 
1 1 1    0   15   17 o 112.7887 1.667213   127.0281   270.0   127.4457 3.759018   127.4457 3.759018 
1 1 1    0   15   18 f 88.65363 1.578441   85.25226   270.0   78.78902 2.796710   78.78902 2.796710 
1 1 1    0   15   19 o 12.21181 5.580882   1.313476    90.0   2.225339 1.473535   2.225339 1.473535 
1 1 1    0   15   20 o 10.41296 5.566021   12.79299    90.0   1.653968 1.563751   1.653968 1.563751 
1 1 1    0   15   21 o 56.56967 1.784750   50.46961    90.0   32.29749 2.014834   32.29749 2.014834 
1 1 1    0   15   22 o 20.72349 4.370332   16.01261    90.0   5.022048 1.593824   5.022048 1.593824 
1 1 1    0   15   23 o 27.10658 3.298176   27.92708   270.0   7.999191 1.744184   7.999191 1.744184 
1 1 1    0   15   24 o 6.779707 4.540883   4.634098   270.0      -0.06 1.653968      -0.06 1.653968 
1 1 1    0   16    0 o 429.1427 5.401192   550.7039     0.0   1843.062 46.34118   1843.062 46.34118 
1 1 1    0   16    1 o 430.3233 3.858220   466.0674   180.0   1852.775 33.19965   1852.775 33.19965 
1 1 1    0   16    2 o 46.48970 1.133494   289.8554     0.0   21.65195 1.052525   21.65195 1.052525 
1 1 1    0   16    3 o 352.2932 3.163203   570.4591     0.0   1241.619 22.28346   1241.619 22.28346 
1 1 1    0   16    4 o 347.3266 3.095850   554.0190     0.0   1206.855 21.50158   1206.855 21.50158 
1 1 1    0   16    5 o 56.57999 1.197063   153.1668     0.0   32.05691 1.353247   32.05691 1.353247 
1 1 1    0   16    6 f 201.5249 2.321108   223.3344   180.0   406.3348 9.352437   406.3348 9.352437 
1 1 1    0   16    7 o 8.755263 4.891749   86.34719   180.0   1.052525 1.263030   1.052525 1.263030 
1 1 1    0   16    8 o 250.0355 2.742931   301.6758     0.0   625.5908 13.71290   625.5908 13.71290 
1 1 1    0   16    9 o 84.70199 1.421033   49.16371     0.0   71.81228 2.405771   71.81228 2.405771 
1 1 1    0   16   10 o 205.5630 2.348668   187.9130   180.0   422.9046 9.653158   422.9046 9.653158 
1 1 1    0   16   11 o 118.2295 1.615824   137.8695     0.0   139.8956 3.819162   139.8956 3.819162 
1 1 1    0   16   12 o 8.935508 4.850995   33.20315     0.0   1.142741 1.202886   1.142741 1.202886 
1 1 1    0   16   13 o 199.9688 3.054393   259.6176   180.0   400.8617 12.20929   400.8617 12.20929 
1 1 1    0   16   14 o 65.63177 2.043326   64.53912   180.0   43.24374 2.676421   43.24374 2.676421 
1 1 1    0   16   15 o 8.443394 5.094022   32.57973   180.0  0.7518036 1.533679  0.7518036 1.533679 
1 1 1    0   16   16 o 56.08469 1.935336   36.87046     0.0   31.60582 2.165194   31.60582 2.165194 
1 1 1    0   16   17 o 92.20591 2.056967   101.9196   180.0   85.31468 3.789090   85.31468 3.789090 
1 1 1    0   16   18 o 111.0666 1.598212   116.0456     0.0   123.6266 3.548513   123.6266 3.548513 
1 1 1    0   16   19 o 49.64256 1.853238   47.71422     0.0   24.83959 1.834401   24.83959 1.834401 
1 1 1    0   16   20 o 10.98014 5.686503   20.02430     0.0   1.864473 1.593824   1.864473 1.593824 
1 1 1    0   16   21 o 32.19444 2.408708   31.32551     0.0   10.67561 1.533679   10.67561 1.533679 
1 1 1    0   16   22 o 5.527753 3.845327   10.21788   180.0 -0.9923807 1.443463 -0.9923807 1.443463 
1 1 1    0   16   23 o 22.26255 4.111239   19.34668   180.0   5.713707 1.653968   5.713707 1.653968 
1 1 1    0   17    1 o 152.8747 1.751244   96.76856    90.0   233.8109 5.352841   233.8109 5.352841 
1 1 1    0   17    2 o 52.85194 1.053562   37.37094   270.0   27.96709 1.112669   27.96709 1.112669 
1 1 1    0   17    3 o 205.9563 2.103068   233.5192    90.0   424.3480 8.660777   424.3480 8.660777 
1 1 1    0   17    4 o 400.3028 3.557729   514.3501    90.0   1603.236 28.47832   1603.236 28.47832 
1 1 1    0   17    5 o 96.97419 1.318491   63.59875    90.0   94.09574 2.556132   94.09574 2.556132 
1 1 1    0   17    6 o 83.34081 1.480460   74.70689    90.0   69.52679 2.465916   69.52679 2.465916 
1 1 1    0   17    7 o 69.79185 1.466445   181.3300    90.0   48.77702 2.044906   48.77702 2.044906 
1 1 1    0   17    8 o 300.2019 3.181297   359.1279    90.0   901.9539 19.09581   901.9539 19.09581 
1 1 1    0   17    9 o 323.0895 3.407463   368.6135    90.0   1044.917 22.01281   1044.917 22.01281 
1 1 1    0   17   10 o 72.67420 1.532555   117.9393    90.0   52.89690 2.225339   52.89690 2.225339 
1 1 1    0   17   11 o 170.8202 2.130896   203.8860   270.0   292.0907 7.277459   292.0907 7.277459 
1 1 1    0   17   12 o 214.7156 2.535802   259.2528   270.0   461.6977 10.88612   461.6977 10.88612 
1 1 1    0   17   13 o 57.07198 1.530493   29.44180   270.0   32.65835 1.744184   32.65835 1.744184 
1 1 1    0   17   14 o 169.9121 2.053715   124.4437   270.0   289.1136 6.976738   289.1136 6.976738 
1 1 1    0   17   15 o 145.4362 2.286095   168.1338   270.0   211.9786 6.645944   211.9786 6.645944 
1 1 1    0   17   16 o 109.3425 1.981649   106.8352    90.0   119.8375 4.330389   119.8375 4.330389 
1 1 1    0   17   17 o 26.97438 3.315570   29.20112   270.0   7.638325 1.744184   7.638325 1.744184 
1 1 1    0   17   18 o 34.60031 3.179182   28.42946   270.0   12.35965 2.165194   12.35965 2.165194 
1 1 1    0   17   19 o 36.64621 2.232798   52.77001    90.0   13.65275 1.623896   13.65275 1.623896 
1 1 1    0   17   20 o 8.188509 4.965082   8.527925    90.0  0.7518036 1.473535  0.7518036 1.473535 
1 1 1    0   17   21 f 18.07297 5.007927   21.19131   270.0   4.089812 1.563751   4.089812 1.563751 
1 1 1    0   17   22 o 18.23901 5.742103   14.04155    90.0   4.450677 1.834401   4.450677 1.834401 
1 1 1    0   17   23 o 9.215084 5.543457   21.58396    90.0   1.293102 1.804329   1.293102 1.804329 
1 1 1    0   18    0 o 538.3489 6.842529   412.8198   180.0   2900.879 73.64668   2900.879 73.64668 
1 1 1    0   18    1 o 67.35758 1.116825   58.61915     0.0   45.40894 1.503607   45.40894 1.503607 
1 1 1    0   18    2 o 172.4391 1.831588   112.9756   180.0   297.4737 6.315150   297.4737 6.315150 
1 1 1    0   18    3 o 432.4976 3.866637   468.5240     0.0   1871.600 33.44022   1871.600 33.44022 
1 1 1    0   18    4 o 267.4067 2.519572   301.2503     0.0   715.3562 13.47232   715.3562 13.47232 
1 1 1    0   18    5 o 200.4355 2.048445   232.0084     0.0   401.9142 8.209695   401.9142 8.209695 
1 1 1    0   18    6 o 177.3495 1.916579   243.2453     0.0   314.6749 6.796305   314.6749 6.796305 
1 1 1    0   18    7 o 163.7793 2.121538   212.0120   180.0   268.4240 6.946666   268.4240 6.946666 
1 1 1    0   18    8 o 355.2491 3.746736   482.8823   180.0   1263.361 26.61385   1263.361 26.61385 
1 1 1    0   18    9 o 197.6335 2.321176   276.2428   180.0   390.9078 9.172004   390.9078 9.172004 
1 1 1    0   18   10 o 186.7264 2.263488   200.8952   180.0   348.9872 8.450273   348.9872 8.450273 
1 1 1    0   18   11 o 113.3151 1.646166   130.1412   180.0   128.5284 3.728946   128.5284 3.728946 
1 1 1    0   18   12 o 53.28093 1.611810   20.38436   180.0   28.47832 1.714112   28.47832 1.714112 
1 1 1    0   18   13 o 84.37650 1.551530   84.15747     0.0   71.30106 2.616277   71.30106 2.616277 
1 1 1    0   18   14 o 56.28434 1.659480   64.20364   180.0   31.78626 1.864473   31.78626 1.864473 
1 1 1    0   18   15 o 46.36910 1.822018   63.45729     0.0   21.62187 1.684040   21.62187 1.684040 
1 1 1    0   18   16 o 17.21992 4.846583   5.200989   180.0   3.608657 1.443463   3.608657 1.443463 
1 1 1    0   18   17 f 8.391872 5.147571  0.5583509   180.0  0.6615872 1.623896  0.6615872 1.623896 
1 1 1    0   18   18 o 103.2339 1.953278   100.2386     0.0   106.9967 4.029667   106.9967 4.029667 
1 1 1    0   18   19 o 37.33589 2.190410   42.26511     0.0   14.16398 1.623896   14.16398 1.623896 
1 1 1    0   18   20 o 15.27229 5.574469   6.067554     0.0   3.217719 1.563751   3.217719 1.563751 
1 1 1    0   18   21 o 11.39903 5.641965   9.371759     0.0   2.074978 1.533679   2.074978 1.533679 
1 1 1    0   18   22 o 6.661289 4.472961   15.75050   180.0 -0.3007214 1.623896 -0.3007214 1.623896 
1 1 1    0   18   23 o 5.399947 3.845917   6.142762   180.0  -1.563751 1.653968  -1.563751 1.653968 
1 1 1    0   19    1 o 164.8708 1.815356   78.32399   270.0   271.9424 5.984357   271.9424 5.984357 
1 1 1    0   19    2 o 434.1939 3.948537   376.4842   270.0   1886.365 34.28225   1886.365 34.28225 
1 1 1    0   19    3 o 413.7155 3.733211   430.7893   270.0   1712.578 30.88409   1712.578 30.88409 
1 1 1    0   19    4 o 98.52345 1.404690   172.8098   270.0   97.13303 2.766637   97.13303 2.766637 
1 1 1    0   19    5 o 386.7475 3.429669   519.5438    90.0   1496.630 26.52363   1496.630 26.52363 
1 1 1    0   19    6 o 10.38069 4.432889   76.59555   270.0   1.533679 0.9322364   1.533679 0.9322364 
1 1 1    0   19    7 o 81.63481 1.622274   113.7048   270.0   66.73009 2.646349   66.73009 2.646349 
1 1 1    0   19    8 o 211.7330 2.536027   264.1216   270.0   448.6764 10.73576   448.6764 10.73576 
1 1 1    0   19    9 o 194.7471 2.394266   190.8563   270.0   379.6308 9.322365   379.6308 9.322365 
1 1 1    0   19   10 o 298.7420 3.141453   293.7585   270.0   893.7742 18.76502   893.7742 18.76502 
1 1 1    0   19   11 f 46.11148 1.634897   87.86989   270.0   21.35122 1.503607   21.35122 1.503607 
1 1 1    0   19   12 o 97.53516 1.666020   108.5232    90.0   95.26855 3.247792   95.26855 3.247792 
1 1 1    0   19   13 o 9.700468 5.095515  0.5954738   270.0   1.383319 1.293102   1.383319 1.293102 
1 1 1    0   19   14 o 5.158830 3.614678   3.539323    90.0  -1.172814 1.323174  -1.172814 1.323174 
1 1 1    0   19   15 o 89.73399 1.525807   84.57317   270.0   80.65350 2.736565   80.65350 2.736565 
1 1 1    0   19   16 f 145.8041 1.825958   142.6700   270.0   213.0010 5.322770   213.0010 5.322770 
1 1 1    0   19   17 o 69.07771 1.634550   77.66826   270.0   47.87486 2.255411   47.87486 2.255411 
1 1 1    0   19   18 o 6.949574 4.456982   5.283094    90.0  0.1804329 1.353247  0.1804329 1.353247 
1 1 1    0   19   19 o 45.06056 2.010724   55.87986    90.0   20.53928 1.804329   20.53928 1.804329 
1 1 1    0   19   20 o 27.29160 2.404526   35.79374    90.0   7.698469 1.293102   7.698469 1.293102 
1 1 1    0   19   21 o 9.045031 5.445432   8.903316   270.0   1.082597 1.744184   1.082597 1.744184 
1 1 1    0   19   22 o 5.064144 3.611885   9.288222   270.0  -1.563751 1.473535  -1.563751 1.473535 
1 1 1    0   19   23 o 4.369948 3.221280   15.07194   270.0  -3.368080 1.653968  -3.368080 1.653968 
1 1 1    0   20    0 o 227.9062 3.386183   149.3450   180.0   519.8271 15.42701   519.8271 15.42701 
1 1 1    0   20    1 o 440.5530 4.120300   441.3036     0.0   1942.179 36.29708   1942.179 36.29708 
1 1 1    0   20    2 o 260.8142 2.600618   321.5997   180.0   680.5627 13.56254   680.5627 13.56254 
1 1 1    0   20    3 o 152.5637 1.823871   177.4899     0.0   232.8787 5.563347   232.8787 5.563347 
1 1 1    0   20    4 o 366.8780 3.299799   428.2234     0.0   1346.781 24.20808   1346.781 24.20808 
1 1 1    0   20    5 o 51.70702 1.368854   49.77998   180.0   26.79428 1.413391   26.79428 1.413391 
1 1 1    0   20    6 o 75.77040 1.310597   93.27564   180.0   57.46787 1.984761   57.46787 1.984761 
1 1 1    0   20    7 o 164.0228 2.118384   142.7584   180.0   269.2359 6.946666   269.2359 6.946666 
1 1 1    0   20    8 o 6.226072 4.178363   39.13915     0.0 -0.4510822 1.413391 -0.4510822 1.413391 
1 1 1    0   20    9 o 255.5862 2.895257   270.5987   180.0   654.0090 14.79550   654.0090 14.79550 
1 1 1    0   20   10 o 54.45038 1.660255   2.118151   180.0   29.74135 1.804329   29.74135 1.804329 
1 1 1    0   20   11 o 11.37104 5.226326   55.67820     0.0   1.894545 1.293102   1.894545 1.293102 
1 1 1    0   20   12 o 109.0451 1.655516   168.8699     0.0   119.0556 3.608657   119.0556 3.608657 
1 1 1    0   20   13 o 112.1412 1.757435   117.8978     0.0   125.9421 3.939451   125.9421 3.939451 
1 1 1    0   20   14 o 26.39150 3.151792   23.53555     0.0   7.277459 1.623896   7.277459 1.623896 
1 1 1    0   20   15 o 83.67263 1.654694   57.11329   180.0   70.15832 2.766637   70.15832 2.766637 
1 1 1    0   20   16 o 120.9231 1.778983   92.90158   180.0   146.5416 4.300317   146.5416 4.300317 
1 1 1    0   20   17 o 66.44468 1.586069   90.38535     0.0   44.29627 2.105050   44.29627 2.105050 
1 1 1    0   20   18 o 56.79156 1.724435   51.98448   180.0   32.44785 1.954689   32.44785 1.954689 
1 1 1    0   20   19 o 12.85671 5.389555   12.74432   180.0   2.405771 1.383319   2.405771 1.383319 
1 1 1    0   20   20 o 46.77983 1.676096   53.15322   180.0   22.10303 1.563751   22.10303 1.563751 
1 1 1    0   20   21 o 43.31879 1.846891   38.14538   180.0   19.06574 1.593824   19.06574 1.593824 
1 1 1    0   20   22 o 8.184301 4.914530   22.47271     0.0  0.9322364 1.413391  0.9322364 1.413391 
1 1 1    0   20   23 o 5.109603 3.620342   10.22109     0.0  -1.202886 1.413391  -1.202886 1.413391 
1 1 1    0   21    1 o 472.5992 4.276817   554.4440   270.0   2235.262 40.41696   2235.262 40.41696 
1 1 1    0   21    2 o 417.4461 3.753881   414.2215   270.0   1743.793 31.33517   1743.793 31.33517 
1 1 1    0   21    3 o 314.7964 3.000219   238.3733   270.0   991.5388 18.88531   991.5388 18.88531 
1 1 1    0   21    4 o 156.0692 1.792498   201.0390    90.0   243.7047 5.593419   243.7047 5.593419 
1 1 1    0   21    5 o 175.6345 1.858204   124.1006    90.0   308.6304 6.525656   308.6304 6.525656 
1 1 1    0   21    6 o 108.3699 1.499117   98.36759    90.0   117.5219 3.247792   117.5219 3.247792 
1 1 1    0   21    7 o 93.46017 1.674374   162.0573   270.0   87.44979 3.127503   87.44979 3.127503 
1 1 1    0   21    8 o 233.2774 2.682155   223.3203    90.0   544.7569 12.51001   544.7569 12.51001 
1 1 1    0   21    9 o 17.80123 4.798567   43.52012   270.0   3.789090 1.473535   3.789090 1.473535 
1 1 1    0   21   10 o 8.354157 5.017342   4.118402    90.0  0.7518036 1.473535  0.7518036 1.473535 
1 1 1    0   21   11 o 49.60207 1.824185   58.68209    90.0   24.71930 1.804329   24.71930 1.804329 
1 1 1    0   21   12 o 97.91372 1.690336   110.4238    90.0   96.02036 3.307936   96.02036 3.307936 
1 1 1    0   21   13 o 33.00243 2.300603   27.60357   270.0   11.06655 1.503607   11.06655 1.503607 
1 1 1    0   21   14 o 100.6134 1.674811   106.9047    90.0   101.4033 3.368080   101.4033 3.368080 
1 1 1    0   21   15 f 211.6725 2.330569   214.3212    90.0   449.1575 9.863664   449.1575 9.863664 
1 1 1    0   21   16 o 45.86016 1.842510   59.00338    90.0   21.17079 1.684040   21.17079 1.684040 
1 1 1    0   21   17 o 5.382912 3.812624   16.97477   270.0  -1.623896 1.563751  -1.623896 1.563751 
1 1 1    0   21   18 o 42.01506 2.050285   42.98679    90.0   17.86285 1.714112   17.86285 1.714112 
1 1 1    0   21   19 o 11.98760 5.575279   10.60732   270.0   2.195267 1.473535   2.195267 1.473535 
1 1 1    0   21   20 o 7.066859 4.557014   7.558331    90.0  0.2105050 1.443463  0.2105050 1.443463 
1 1 1    0   21   21 o 42.81559 1.797880   32.64671    90.0   18.61466 1.533679   18.61466 1.533679 
1 1 1    0   21   22 o 7.129734 4.564090   12.63098    90.0  0.3909379 1.413391  0.3909379 1.413391 
1 1 1    0   22    0 o 237.4046 3.472433   211.4545   180.0   564.0933 16.47953   564.0933 16.47953 
1 1 1    0   22    1 o 17.42169 3.619888   29.53143   180.0   3.398152 1.112669   3.398152 1.112669 
1 1 1    0   22    2 o 231.0867 2.206217   9.353355     0.0   534.2617 10.19446   534.2617 10.19446 
1 1 1    0   22    3 o 253.3048 2.618386   235.3795     0.0   642.0403 13.26182   642.0403 13.26182 
1 1 1    0   22    4 o 153.3824 1.647330   146.5219   180.0   235.3747 5.052120   235.3747 5.052120 
1 1 1    0   22    5 o 5.475326 3.684510   127.0708   180.0 -0.3909379 1.112669 -0.3909379 1.112669 
1 1 1    0   22    6 o 180.2211 1.919407   270.2841   180.0   324.9897 6.916593   324.9897 6.916593 
1 1 1    0   22    7 o 153.6648 2.016485   175.6308     0.0   236.3370 6.194862   236.3370 6.194862 
1 1 1    0   22    8 o 119.1624 1.855874   102.6046   180.0   142.1510 4.420605   142.1510 4.420605 
1 1 1    0   22    9 o 167.9918 2.077224   209.8077   180.0   282.4977 6.976738   282.4977 6.976738 
1 1 1    0   22   10 o 37.90328 1.995161   64.46956     0.0   14.49477 1.503607   14.49477 1.503607 
1 1 1    0   22   11 o 185.1577 2.315207   192.2782     0.0   343.3638 8.570561   343.3638 8.570561 
1 1 1    0   22   12 o 26.15064 2.878190   45.12229   180.0   7.097026 1.473535   7.097026 1.473535 
1 1 1    0   22   13 o 84.19044 1.554969   63.94134   180.0   71.00034 2.616277   71.00034 2.616277 
1 1 1    0   22   14 o 166.6507 2.093963   150.8297     0.0   278.2575 6.976738   278.2575 6.976738 
1 1 1    0   22   15 o 111.1799 2.260605   101.4296     0.0   124.0476 5.022048   124.0476 5.022048 
1 1 1    0   22   16 o 44.21753 2.049724   50.34313   180.0   19.72733 1.804329   19.72733 1.804329 
1 1 1    0   22   17 o 101.3794 1.766145   65.81516     0.0   103.1475 3.578585   103.1475 3.578585 
1 1 1    0   22   18 o 29.83668 2.555682   27.93429     0.0   9.172004 1.503607   9.172004 1.503607 
1 1 1    0   22   19 o 27.47105 3.251175   31.61302     0.0   7.999191 1.744184   7.999191 1.744184 
1 1 1    0   22   20 o 6.105327 4.153020   1.761477   180.0 -0.5412986 1.473535 -0.5412986 1.473535 
1 1 1    0   22   21 o 15.92459 5.234130   10.26704   180.0   3.428224 1.473535   3.428224 1.473535 
1 1 1    0   22   22 o 8.274206 4.880423   19.25118   180.0   1.052525 1.353247   1.052525 1.353247 
1 1 1    0   23    1 o 51.64328 1.429067   19.82449   270.0   26.73414 1.473535   26.73414 1.473535 
1 1 1    0   23    2 o 41.66538 1.629360   159.4474    90.0   17.44184 1.353247   17.44184 1.353247 
1 1 1    0   23    3 f 5.563683 3.740904   24.23742   270.0 -0.3909379 1.142741 -0.3909379 1.142741 
1 1 1    0   23    4 o 152.1563 1.739740   137.6588    90.0   231.6457 5.292697   231.6457 5.292697 
1 1 1    0   23    5 o 139.9471 1.708884   222.8998    90.0   195.9802 4.781471   195.9802 4.781471 
1 1 1    0   23    6 o 28.09492 2.110902   7.552304   270.0   8.029263 1.172814   8.029263 1.172814 
1 1 1    0   23    7 o 38.48837 1.805565   35.44125    90.0   14.91578 1.383319   14.91578 1.383319 
1 1 1    0   23    8 o 169.3650 2.175893   228.2254   270.0   287.1589 7.367675   287.1589 7.367675 
1 1 1    0   23    9 o 5.247194 3.682134   46.61506    90.0  -1.263030 1.383319  -1.263030 1.383319 
1 1 1    0   23   10 o 9.857485 5.402829   39.16702   270.0   1.383319 1.503607   1.383319 1.503607 
1 1 1    0   23   11 o 103.0522 1.898233   121.7441    90.0   106.3952 3.909379   106.3952 3.909379 
1 1 1    0   23   12 o 57.85914 1.901587   101.3914    90.0   33.62066 2.195267   33.62066 2.195267 
1 1 1    0   23   13 o 60.01481 1.782295   49.23779    90.0   36.14672 2.135122   36.14672 2.135122 
1 1 1    0   23   14 o 36.65973 2.652804   62.82836    90.0   13.68283 1.924617   13.68283 1.924617 
1 1 1    0   23   15 o 32.05107 2.857792   43.48293   270.0   10.55532 1.804329   10.55532 1.804329 
1 1 1    0   23   16 o 4.860569 3.503823   8.238140    90.0  -2.135122 1.503607  -2.135122 1.503607 
1 1 1    0   23   17 o 10.43681 5.451419   16.73661    90.0   1.653968 1.473535   1.653968 1.473535 
1 1 1    0   23   18 o 64.13975 1.737579   66.26861   270.0   41.40934 2.225339   41.40934 2.225339 
1 1 1    0   23   19 o 63.69679 1.631164   70.82351   270.0   40.86804 2.074978   40.86804 2.074978 
1 1 1    0   23   20 o 19.11446 4.436811   19.89567    90.0   4.360461 1.473535   4.360461 1.473535 
1 1 1    0   23   21 o 23.59408 3.535792   29.20356   270.0   6.074574 1.593824   6.074574 1.593824 
1 1 1    0   23   22 o 21.74153 3.668191   20.23673    90.0   5.382914 1.473535   5.382914 1.473535 
1 1 1    0   24    0 o 111.4671 2.187136   126.0854   180.0   124.4085 4.871688   124.4085 4.871688 
1 1 1    0   24    1 o 280.4473 2.654457   237.3051     0.0   787.0181 14.88571   787.0181 14.88571 
1 1 1    0   24    2 o 35.06287 1.767754   74.13983     0.0   12.38972 1.232958   12.38972 1.232958 
1 1 1    0   24    3 o 138.1360 1.633259   134.8076   180.0   190.9281 4.510822   190.9281 4.510822 
1 1 1    0   24    4 o 202.0167 2.099431   161.1421   180.0   408.3797 8.480345   408.3797 8.480345 
1 1 1    0   24    5 o 42.92502 1.475019   10.03710   180.0   18.49437 1.263030   18.49437 1.263030 
1 1 1    0   24    6 o 136.8228 1.736961   90.42533     0.0   187.3495 4.751399   187.3495 4.751399 
1 1 1    0   24    7 o 116.7452 1.546135   124.1988   180.0   136.4073 3.608657   136.4073 3.608657 
1 1 1    0   24    8 o 90.34709 1.615482   81.79208   180.0   81.73608 2.916998   81.73608 2.916998 
1 1 1    0   24    9 o 101.5719 1.644138   102.3036   180.0   103.2978 3.338008   103.2978 3.338008 
1 1 1    0   24   10 o 7.240846 4.577719   22.31894   180.0  0.2706493 1.383319  0.2706493 1.383319 
1 1 1    0   24   11 o 31.31926 2.528613   4.380592     0.0   10.01402 1.563751   10.01402 1.563751 
1 1 1    0   24   12 o 119.0563 1.806934   134.7325   180.0   141.9706 4.300317   141.9706 4.300317 
1 1 1    0   24   13 o 53.93657 1.872722   43.03568     0.0   29.23012 2.014834   29.23012 2.014834 
1 1 1    0   24   14 o 62.77401 1.727487   70.36308   180.0   39.54487 2.165194   39.54487 2.165194 
1 1 1    0   24   15 o 6.148092 4.272615   26.50854   180.0  -1.263030 1.744184  -1.263030 1.744184 
1 1 1    0   24   16 o 80.19931 1.651418   84.96244     0.0   64.53483 2.646349   64.53483 2.646349 
1 1 1    0   24   17 o 50.66507 1.935174   45.83747   180.0   25.89212 1.954689   25.89212 1.954689 
1 1 1    0   24   18 o 49.73362 1.910828   52.38830   180.0   24.98995 1.894545   24.98995 1.894545 
1 1 1    0   24   19 f 27.89829 2.969968   24.26422     0.0   8.209695 1.623896   8.209695 1.623896 
1 1 1    0   24   20 o 68.80739 1.684877   71.35004     0.0   47.84478 2.315555   47.84478 2.315555 
1 1 1    0   24   21 o 8.091556 5.070395   1.954825     0.0  0.7217315 1.653968  0.7217315 1.653968 
1 1 1    0   24   22 o 46.18272 1.895262   46.47193     0.0   21.92259 1.744184   21.92259 1.744184 
1 1 1    0   25    1 o 173.8007 2.042346   182.4996    90.0   302.2852 7.097026   302.2852 7.097026 
1 1 1    0   25    2 o 170.8367 1.831169   137.1275    90.0   292.0306 6.255006   292.0306 6.255006 
1 1 1    0   25    3 o 8.346175 4.730784   8.649217   270.0  0.9322364 1.202886  0.9322364 1.202886 
1 1 1    0   25    4 f 402.2202 3.566939   377.7318   270.0   1620.077 28.68883   1620.077 28.68883 
1 1 1    0   25    5 o 106.9451 1.406507   136.8851   270.0   114.4546 3.007215   114.4546 3.007215 
1 1 1    0   25    6 o 97.69909 1.447389   37.08188   270.0   95.53921 2.826782   95.53921 2.826782 
1 1 1    0   25    7 o 60.64630 1.290540   41.46124   270.0   36.83838 1.563751   36.83838 1.563751 
1 1 1    0   25    8 o 103.7572 1.798165   143.2754    90.0   107.8086 3.728946   107.8086 3.728946 
1 1 1    0   25    9 o 7.345647 4.738974   15.95485   270.0       0.09 1.563751       0.09 1.563751 
1 1 1    0   25   10 o 57.05288 1.689966   69.09144    90.0   32.65835 1.924617   32.65835 1.924617 
1 1 1    0   25   11 o 27.12865 3.118747   35.14995    90.0   7.668397 1.653968   7.668397 1.653968 
1 1 1    0   25   12 o 78.65630 1.511422   82.67242    90.0   61.97869 2.375700   61.97869 2.375700 
1 1 1    0   25   13 o 4.782043 3.462631   32.62023   270.0  -2.646349 1.593824  -2.646349 1.593824 
1 1 1    0   25   14 o 5.969458 4.146302   16.21972    90.0  -1.142741 1.623896  -1.142741 1.623896 
1 1 1    0   25   15 o 12.78142 5.752314   26.80581   270.0   2.405771 1.563751   2.405771 1.563751 
1 1 1    0   25   16 o 46.94148 2.058543   39.39732   270.0   22.25339 1.924617   22.25339 1.924617 
1 1 1    0   25   17 o 33.44754 2.453906   35.22265   270.0   11.45749 1.623896   11.45749 1.623896 
1 1 1    0   25   18 o 6.653944 4.407910   37.13676   270.0 -0.1503607 1.473535 -0.1503607 1.473535 
1 1 1    0   25   19 f 9.575413 5.438973   10.67310   270.0   1.383319 1.593824   1.383319 1.593824 
1 1 1    0   25   20 o 5.496428 3.914761   2.725209   270.0  -1.774257 1.714112  -1.774257 1.714112 
1 1 1    0   25   21 o 23.36479 3.791270   26.27052   270.0   6.134717 1.653968   6.134717 1.653968 
1 1 1    0   26    0 o 24.73079 3.228337   21.98466   180.0   6.224934 1.593824   6.224934 1.593824 
1 1 1    0   26    1 f 264.3727 2.611113   264.0849   180.0   699.5683 13.80311   699.5683 13.80311 
1 1 1    0   26    2 o 128.6635 1.660082   106.3198     0.0   165.6674 4.270245   165.6674 4.270245 
1 1 1    0   26    3 o 70.52426 1.344277   27.26944     0.0   49.79947 1.894545   49.79947 1.894545 
1 1 1    0   26    4 o 97.77923 1.415401   135.9407     0.0   95.68957 2.766637   95.68957 2.766637 
1 1 1    0   26    5 o 50.12842 1.472563   25.33417   180.0   25.20046 1.473535   25.20046 1.473535 
1 1 1    0   26    6 o 5.647967 3.768067   40.31572   180.0 -0.2706493 1.112669 -0.2706493 1.112669 
1 1 1    0   26    7 o 199.8492 2.092106   154.6521     0.0   399.8092 8.360056   399.8092 8.360056 
1 1 1    0   26    8 o 55.87722 1.752888   54.95452     0.0   31.33517 1.954689   31.33517 1.954689 
1 1 1    0   26    9 o 177.5834 2.117438   166.0769     0.0   315.8177 7.518036   315.8177 7.518036 
1 1 1    0   26   10 o 59.55326 1.669273   39.19152     0.0   35.57535 1.984761   35.57535 1.984761 
1 1 1    0   26   11 o 117.1943 1.861406   146.4636     0.0   137.5801 4.360461   137.5801 4.360461 
1 1 1    0   26   12 o 29.26180 2.930938   3.088748   180.0   8.841210 1.684040   8.841210 1.684040 
1 1 1    0   26   13 o 25.71427 3.366083   27.90889     0.0   6.976738 1.684040   6.976738 1.684040 
1 1 1    0   26   14 o 47.15860 2.145766   62.29755     0.0   22.43382 2.014834   22.43382 2.014834 
1 1 1    0   26   15 o 27.91512 3.310005   42.30141     0.0   8.179624 1.804329   8.179624 1.804329 
1 1 1    0   26   16 o 39.37970 2.307437   16.87269     0.0   15.75780 1.804329   15.75780 1.804329 
1 1 1    0   26   17 f 32.33067 2.638571   32.03962   180.0   10.76583 1.684040   10.76583 1.684040 
1 1 1    0   26   18 o 13.37194 5.744807   22.72916     0.0   2.676421 1.563751   2.676421 1.563751 
1 1 1    0   26   19 o 21.99276 3.796754   24.52525     0.0   5.382914 1.533679   5.382914 1.533679 
1 1 1    0   26   20 f 27.20065 3.458249   8.541853     0.0   7.848830 1.894545   7.848830 1.894545 
1 1 1    0   26   21 o 8.075024 5.064095   12.77974   180.0  0.8119479 1.653968  0.8119479 1.653968 
1 1 1    0   27    1 o 155.9115 1.726747   131.8242   270.0   243.2536 5.382914   243.2536 5.382914 
1 1 1    0   27    2 o 153.8234 1.994830   116.1946   270.0   236.8482 6.134717   236.8482 6.134717 
1 1 1    0   27    3 o 64.57828 1.375114   100.9660   270.0   41.77021 1.774257   41.77021 1.774257 
1 1 1    0   27    4 o 52.87646 1.424097   69.25676    90.0   28.02724 1.503607   28.02724 1.503607 
1 1 1    0   27    5 o 32.93481 2.024592   14.68939   270.0   10.97633 1.323174   10.97633 1.323174 
1 1 1    0   27    6 o 98.52666 1.389362   100.4969   270.0   97.16310 2.736565   97.16310 2.736565 
1 1 1    0   27    7 o 48.86084 1.634998   79.22596    90.0   23.96750 1.593824   23.96750 1.593824 
1 1 1    0   27    8 o 38.87615 2.219709   77.93567    90.0   15.27665 1.714112   15.27665 1.714112 
1 1 1    0   27    9 o 80.36031 1.741928   63.47828    90.0   64.71526 2.796710   64.71526 2.796710 
1 1 1    0   27   10 o 63.35546 1.950163   107.1574   270.0   40.29667 2.465916   40.29667 2.465916 
1 1 1    0   27   11 o 85.96152 1.803406   90.90762    90.0   74.06770 3.097431   74.06770 3.097431 
1 1 1    0   27   12 f 94.97853 1.726856   138.3197    90.0   90.39687 3.277864   90.39687 3.277864 
1 1 1    0   27   13 o 21.43671 4.548471   23.04358   270.0   5.202481 1.714112   5.202481 1.714112 
1 1 1    0   27   14 o 9.526215 5.493435   17.10238    90.0   1.202886 1.653968   1.202886 1.653968 
1 1 1    0   27   15 o 11.83843 5.903445   25.31002    90.0   2.135122 1.684040   2.135122 1.684040 
1 1 1    0   27   16 o 84.90176 1.861538   73.46462   270.0   72.50394 3.157575   72.50394 3.157575 
1 1 1    0   27   17 o 40.85430 2.372144   53.58982   270.0   17.02083 1.924617   17.02083 1.924617 
1 1 1    0   27   18 o 11.13228 5.661893   4.999523    90.0   1.984761 1.563751   1.984761 1.563751 
1 1 1    0   27   19 o 6.322112 4.341963   8.523297    90.0 -0.7518036 1.684040 -0.7518036 1.684040 
1 1 1    0   27   20 o 27.32069 3.037047   29.51949    90.0   8.029263 1.623896   8.029263 1.623896 
1 1 1    0   27   21 o 6.193707 4.245697   2.519305    90.0 -0.4811543 1.593824 -0.4811543 1.593824 
1 1 1    0   28    0 o 320.0696 4.163786   402.6401   180.0   1026.092 26.64392   1026.092 26.64392 
1 1 1    0   28    1 o 111.9486 1.518355   111.5804     0.0   125.4309 3.398152   125.4309 3.398152 
1 1 1    0   28    2 o 91.64146 1.559722   90.35440   180.0   84.08172 2.856854   84.08172 2.856854 
1 1 1    0   28    3 o 150.9719 1.773342   126.8741     0.0   228.1273 5.352841   228.1273 5.352841 
1 1 1    0   28    4 o 55.31553 1.470147   49.72997     0.0   30.67359 1.623896   30.67359 1.623896 
1 1 1    0   28    5 o 50.45582 1.462937   104.3271     0.0   25.53125 1.473535   25.53125 1.473535 
1 1 1    0   28    6 o 41.25047 1.682797   63.99554     0.0   17.11105 1.383319   17.11105 1.383319 
1 1 1    0   28    7 o 5.386835 3.703866   24.91589   180.0 -0.7217315 1.232958 -0.7217315 1.232958 
1 1 1    0   28    8 o 56.36646 1.898688   62.23954   180.0   31.90655 2.135122   31.90655 2.135122 
1 1 1    0   28    9 o 6.309981 4.335898   2.181645     0.0 -0.9623086 1.684040 -0.9623086 1.684040 
1 1 1    0   28   10 o 66.24262 1.841724   62.68118     0.0   44.02562 2.435844   44.02562 2.435844 
1 1 1    0   28   11 o 58.86633 1.843052   78.09990     0.0   34.79347 2.165194   34.79347 2.165194 
1 1 1    0   28   12 o 23.42072 4.700089   2.914028     0.0   6.134717 1.954689   6.134717 1.954689 
1 1 1    0   28   13 o 106.6968 1.889697   82.23184   180.0   114.1839 4.029667   114.1839 4.029667 
1 1 1    0   28   14 o 25.05287 3.506057   35.07423   180.0   6.525656 1.714112   6.525656 1.714112 
1 1 1    0   28   15 o 22.49274 4.140012   24.30155   180.0   5.593419 1.684040   5.593419 1.684040 
1 1 1    0   28   16 o 94.31974 1.882781   80.25966   180.0   89.52478 3.548513   89.52478 3.548513 
1 1 1    0   28   17 o 58.32504 1.860305   59.48119     0.0   34.34239 2.165194   34.34239 2.165194 
1 1 1    0   28   18 o 16.17459 5.733813   33.97472     0.0   3.638730 1.684040   3.638730 1.684040 
1 1 1    0   28   19 o 6.825787 4.542810   4.905766   180.0 -0.1202886 1.593824 -0.1202886 1.593824 
1 1 1    0   28   20 o 37.06927 2.414117   32.00666   180.0   14.31434 1.774257   14.31434 1.774257 
1 1 1    0   29    1 o 70.04561 1.396535   96.75677   270.0   49.13788 1.954689   49.13788 1.954689 
1 1 1    0   29    2 o 9.276114 4.858296   24.29916    90.0   1.263030 1.172814   1.263030 1.172814 
1 1 1    0   29    3 o 181.3031 2.007539   178.0213   270.0   329.0494 7.277459   329.0494 7.277459 
1 1 1    0   29    4 o 30.44127 2.145401   10.68301   270.0   9.412581 1.293102   9.412581 1.293102 
1 1 1    0   29    5 o 151.2388 1.760258   163.7121   270.0   228.9693 5.322770   228.9693 5.322770 
1 1 1    0   29    6 o 60.00964 1.404852   76.45927    90.0   36.08657 1.684040   36.08657 1.684040 
1 1 1    0   29    7 f 4.942182 3.501988   20.40290    90.0  -1.413391 1.323174  -1.413391 1.323174 
1 1 1    0   29    8 o 63.76900 1.842555   46.51091   270.0   40.80790 2.345627   40.80790 2.345627 
1 1 1    0   29    9 o 75.36929 1.817785   65.45118   270.0   56.95664 2.736565   56.95664 2.736565 
1 1 1    0   29   10 o 156.4463 2.336643   130.5217    90.0   245.3586 7.307531   245.3586 7.307531 
1 1 1    0   29   11 o 176.4034 2.174281   163.9903   270.0   311.9083 7.668397   311.9083 7.668397 
1 1 1    0   29   12 o 23.48864 4.679957   18.19687   270.0   6.164790 1.954689   6.164790 1.954689 
1 1 1    0   29   13 o 48.21788 2.319038   58.48711   270.0   23.48635 2.225339   23.48635 2.225339 
1 1 1    0   29   14 o 21.64845 4.862243   36.41184    90.0   5.412986 1.834401   5.412986 1.834401 
1 1 1    0   29   15 o 27.69956 3.280010   28.35798    90.0   8.089407 1.774257   8.089407 1.774257 
1 1 1    0   29   16 o 37.55165 2.505262   42.85635    90.0   14.43463 1.864473   14.43463 1.864473 
1 1 1    0   29   17 o 60.35911 1.847226   55.01753   270.0   36.83838 2.225339   36.83838 2.225339 
1 1 1    0   29   18 f 27.64770 3.286618   22.61760    90.0   8.209695 1.774257   8.209695 1.774257 
1 1 1    0   29   19 o 34.27591 2.799990   35.13379    90.0   12.35965 1.894545   12.35965 1.894545 
1 1 1    0   29   20 o 39.25171 2.432616   39.68407    90.0   16.11867 1.894545   16.11867 1.894545 
1 1 1    0   30    0 o 54.33207 1.998454   64.30633     0.0   29.65113 2.165194   29.65113 2.165194 
1 1 1    0   30    1 o 188.0541 1.887391   175.1470   180.0   354.0093 7.097026   354.0093 7.097026 
1 1 1    0   30    2 o 12.30912 5.077213   32.25080     0.0   2.135122 1.232958   2.135122 1.232958 
1 1 1    0   30    3 o 80.41296 1.384611   92.75841   180.0   64.74533 2.225339   64.74533 2.225339 
1 1 1    0   30    4 o 84.34935 1.444849   62.53035     0.0   71.24091 2.435844   71.24091 2.435844 
1 1 1    0   30    5 o 57.35421 1.575599   59.45538   180.0   32.98914 1.804329   32.98914 1.804329 
1 1 1    0   30    6 o 29.21991 2.398453   23.23228     0.0   8.720922 1.383319   8.720922 1.383319 
1 1 1    0   30    7 o 132.1625 1.878047   125.8636     0.0   174.9597 4.961904   174.9597 4.961904 
1 1 1    0   30    8 o 6.979579 4.299856   21.41657     0.0  0.4210100 1.142741  0.4210100 1.142741 
1 1 1    0   30    9 f 75.47568 1.875212   109.0272     0.0   57.13707 2.826782   57.13707 2.826782 
1 1 1    0   30   10 o 48.37539 2.469127   35.36101   180.0   23.63671 2.375700   23.63671 2.375700 
1 1 1    0   30   11 o 20.88144 5.753425   15.90165     0.0   5.292697 2.074978   5.292697 2.074978 
1 1 1    0   30   12 o 37.62532 2.541207   24.23351     0.0   14.40456 1.894545   14.40456 1.894545 
1 1 1    0   30   13 o 119.3606 1.941114   103.2204     0.0   142.9930 4.631110   142.9930 4.631110 
1 1 1    0   30   14 o 59.92317 1.961812   59.66212     0.0   36.17679 2.345627   36.17679 2.345627 
1 1 1    0   30   15 o 25.38722 3.505482   39.50434   180.0   6.736160 1.744184   6.736160 1.744184 
1 1 1    0   30   16 o 47.02820 2.119430   55.80781   180.0   22.43382 1.984761   22.43382 1.984761 
1 1 1    0   30   17 f 32.29990 2.834635   43.15441   180.0   10.88612 1.804329   10.88612 1.804329 
1 1 1    0   30   18 o 26.63143 3.522318   21.10317     0.0   7.518036 1.864473   7.518036 1.864473 
1 1 1    0   30   19 o 29.77939 3.035891   25.88188     0.0   9.502798 1.774257   9.502798 1.774257 
1 1 1    0   30   20 o 29.21675 3.479331   25.99415   180.0   9.532870 1.984761   9.532870 1.984761 
1 1 1    0   31    1 o 57.63376 1.410682   46.41876    90.0   33.28986 1.623896   33.28986 1.623896 
1 1 1    0   31    2 o 53.52016 1.435089   54.81237    90.0   28.71890 1.533679   28.71890 1.533679 
1 1 1    0   31    3 o 53.34413 1.496510   81.96616    90.0   28.53847 1.593824   28.53847 1.593824 
1 1 1    0   31    4 o 223.0101 2.259200   233.6790    90.0   498.0850 10.07417   498.0850 10.07417 
1 1 1    0   31    5 o 82.05840 1.338421   30.77501    90.0   67.42175 2.195267   67.42175 2.195267 
1 1 1    0   31    6 o 100.9626 1.475083   86.84045   270.0   102.0649 2.977142   102.0649 2.977142 
1 1 1    0   31    7 o 25.41692 2.967230   10.37311   270.0   6.736160 1.473535   6.736160 1.473535 
1 1 1    0   31    8 o 46.49246 1.849784   71.33683   270.0   21.74216 1.714112   21.74216 1.714112 
1 1 1    0   31    9 o 5.883321 4.158400   5.993786    90.0  -1.864473 1.834401  -1.864473 1.834401 
1 1 1    0   31   10 o 124.2404 2.192060   120.3153    90.0   154.8415 5.443058   154.8415 5.443058 
1 1 1    0   31   11 o 4.721904 3.463187   5.496192   270.0  -3.548513 1.774257  -3.548513 1.774257 
1 1 1    0   31   12 o 43.20992 2.381443   15.62899   270.0   18.91538 2.044906   18.91538 2.044906 
1 1 1    0   31   13 o 76.32749 1.794852   59.20695   270.0   58.55046 2.736565   58.55046 2.736565 
1 1 1    0   31   14 o 46.92683 2.351582   53.94254   270.0   22.34361 2.195267   22.34361 2.195267 
1 1 1    0   31   15 o 12.56758 6.344038   31.26349   270.0   2.495988 1.954689   2.495988 1.954689 
1 1 1    0   31   16 o 12.01755 6.312795   1.643361    90.0   2.345627 1.984761   2.345627 1.984761 
1 1 1    0   31   17 o 34.30814 2.751832   42.65435   270.0   12.26943 1.864473   12.26943 1.864473 
1 1 1    0   31   18 f 12.12763 5.970837   28.28370   270.0   2.465916 1.714112   2.465916 1.714112 
1 1 1    0   31   19 o 20.32297 4.957893   14.58719    90.0   5.232553 1.744184   5.232553 1.744184 
1 1 1    0   32    0 o 189.3495 2.860188   129.6648   180.0   359.1216 10.82597   359.1216 10.82597 
1 1 1    0   32    1 o 43.34215 1.705623   57.84044   180.0   18.88531 1.473535   18.88531 1.473535 
1 1 1    0   32    2 o 201.3837 2.053734   218.9536   180.0   406.0942 8.269840   406.0942 8.269840 
1 1 1    0   32    3 o 51.62532 1.488124   52.93180     0.0   26.73414 1.533679   26.73414 1.533679 
1 1 1    0   32    4 o 22.97573 3.028085   17.27638   180.0   5.563347 1.353247   5.563347 1.353247 
1 1 1    0   32    5 o 95.38445 1.387859   87.95477     0.0   91.08852 2.646349   91.08852 2.646349 
1 1 1    0   32    6 o 101.6397 1.539314   105.3997   180.0   103.4482 3.127503   103.4482 3.127503 
1 1 1    0   32    7 o 89.17883 1.535331   62.08886   180.0   79.66111 2.736565   79.66111 2.736565 
1 1 1    0   32    8 o 53.02599 1.733788   33.23620   180.0   28.23775 1.834401   28.23775 1.834401 
1 1 1    0   32    9 o 110.4356 2.016557   100.6652   180.0   122.3034 4.450677   122.3034 4.450677 
1 1 1    0   32   10 o 68.50518 1.890782   69.60682   180.0   47.12305 2.586205   47.12305 2.586205 
1 1 1    0   32   11 o 12.76428 6.319845   30.29788   180.0   2.465916 1.924617   2.465916 1.924617 
1 1 1    0   32   12 o 74.36427 1.903395   65.69173     0.0   55.57333 2.826782   55.57333 2.826782 
1 1 1    0   32   13 o 12.09369 6.175305   3.227884     0.0   2.255411 1.864473   2.255411 1.864473 
1 1 1    0   32   14 o 7.355053 4.809731   8.435207   180.0   0.000000 1.684040   0.000000 1.684040 
1 1 1    0   32   15 o 8.973588 5.422574   17.80937   180.0  0.9623086 1.744184  0.9623086 1.744184 
1 1 1    0   32   16 o 11.76082 6.170534   32.17883     0.0   2.255411 1.894545   2.255411 1.894545 
1 1 1    0   32   17 f 44.97355 2.421988   36.59083   180.0   20.77985 2.165194   20.77985 2.165194 
1 1 1    0   32   18 o 14.32350 6.057377   25.04349     0.0   3.247792 1.744184   3.247792 1.744184 
1 1 1    0   32   19 o 9.706686 5.675196   2.740038     0.0   1.653968 1.804329   1.653968 1.804329 
1 1 1    0   33    1 o 218.3851 2.286421   189.8042   270.0   477.8163 9.983953   477.8163 9.983953 
1 1 1    0   33    2 o 152.4565 1.923880   148.3576   270.0   232.7885 5.864068   232.7885 5.864068 
1 1 1    0   33    3 o 98.36784 1.514073   86.47295   270.0   96.89246 2.977142   96.89246 2.977142 
1 1 1    0   33    4 o 36.09718 2.054996   84.22569   270.0   13.17160 1.473535   13.17160 1.473535 
1 1 1    0   33    5 o 80.00702 1.429320   99.95842    90.0   64.11382 2.285483   64.11382 2.285483 
1 1 1    0   33    6 f 41.38649 1.934586   40.86652    90.0   17.26141 1.593824   17.26141 1.593824 
1 1 1    0   33    7 o 215.6738 2.259379   191.2330   270.0   466.1784 9.743376   466.1784 9.743376 
1 1 1    0   33    8 o 180.5076 1.941367   181.8809    90.0   326.4933 7.006810   326.4933 7.006810 
1 1 1    0   33    9 o 25.52776 4.172331   32.76303   270.0   6.976738 1.984761   6.976738 1.984761 
1 1 1    0   33   10 o 179.5141 2.597773   181.8268   270.0   323.7567 9.322365   323.7567 9.322365 
1 1 1    0   33   11 o 118.9161 1.961054   94.42013   270.0   141.9405 4.661182   141.9405 4.661182 
1 1 1    0   33   12 f 123.6823 2.019269   113.7356   270.0   153.7889 4.991976   153.7889 4.991976 
1 1 1    0   33   13 f 35.08119 2.865994   18.10275   270.0   12.69044 1.984761   12.69044 1.984761 
1 1 1    0   33   14 o 31.54421 3.005846   20.41678   270.0   10.37489 1.864473   10.37489 1.864473 
1 1 1    0   33   15 o 8.310310 5.224739   2.388822   270.0  0.6014429 1.774257  0.6014429 1.774257 
1 1 1    0   33   16 o 7.927046 5.182989   17.69068   270.0  0.1804329 1.954689  0.1804329 1.954689 
1 1 1    0   33   17 o 64.69991 2.049617   59.81537    90.0   42.67237 2.646349   42.67237 2.646349 
1 1 1    0   33   18 o 19.93948 5.982020   12.86888   270.0   5.503202 2.074978   5.503202 2.074978 
1 1 1    0   34    0 o 38.27204 2.901012   5.424345   180.0   14.91578 2.195267   14.91578 2.195267 
1 1 1    0   34    1 o 37.72577 2.045326   58.69376   180.0   14.37449 1.533679   14.37449 1.533679 
1 1 1    0   34    2 f 40.18844 1.841577   36.00676   180.0   16.26903 1.473535   16.26903 1.473535 
1 1 1    0   34    3 o 88.83844 1.388624   63.72320     0.0   79.02959 2.465916   79.02959 2.465916 
1 1 1    0   34    4 o 7.675441 4.755610   11.04855   180.0  0.4811543 1.413391  0.4811543 1.413391 
1 1 1    0   34    5 o 25.90374 2.723708   22.02581   180.0   6.946666 1.383319   6.946666 1.383319 
1 1 1    0   34    6 o 26.38690 2.971109   45.42481   180.0   7.247387 1.533679   7.247387 1.533679 
1 1 1    0   34    7 f 5.779568 4.011618   7.679140   180.0  -1.022453 1.503607  -1.022453 1.503607 
1 1 1    0   34    8 o 5.237202 3.716122   19.69106   180.0  -1.623896 1.503607  -1.623896 1.503607 
1 1 1    0   34    9 o 53.55771 2.282991   54.38142   180.0   28.92940 2.435844   28.92940 2.435844 
1 1 1    0   34   10 o 8.594574 5.476651   5.257529   180.0  0.3608657 2.014834  0.3608657 2.014834 
1 1 1    0   34   11 o 84.57118 1.797507   68.33892   180.0   71.87243 3.037287   71.87243 3.037287 
1 1 1    0   34   12 o 10.55012 6.122494   2.296562     0.0   1.533679 2.074978   1.533679 2.074978 
1 1 1    0   34   13 o 6.967907 4.728415  0.5622048   180.0 -0.6916593 1.894545 -0.6916593 1.894545 
1 1 1    0   34   14 f 7.460933 4.991359   4.088499     0.0 -0.3608657 1.984761 -0.3608657 1.984761 
1 1 1    0   34   15 o 34.61098 3.178148   29.42056   180.0   12.60023 2.165194   12.60023 2.165194 
1 1 1    0   34   16 f 7.141989 4.783183   28.09898   180.0 -0.2706493 1.834401 -0.2706493 1.834401 
1 1 1    0   34   17 o 14.21570 6.230261   13.54088   180.0   3.277864 1.834401   3.277864 1.834401 
1 1 1    0   34   18 o 5.829066 4.128805   6.884836   180.0  -1.443463 1.834401  -1.443463 1.834401 
1 1 1    0   35    1 o 108.4016 1.540345   83.84821    90.0   117.6723 3.338008   117.6723 3.338008 
1 1 1    0   35    2 o 45.68220 1.816531   41.92290   270.0   20.99036 1.653968   20.99036 1.653968 
1 1 1    0   35    3 o 164.8230 1.779364   172.6776   270.0   272.0627 5.864068   272.0627 5.864068 
1 1 1    0   35    4 o 6.324567 4.226319   5.294862   270.0 -0.3608657 1.413391 -0.3608657 1.413391 
1 1 1    0   35    5 o 52.23695 1.615324   26.72069   270.0   27.39572 1.684040   27.39572 1.684040 
1 1 1    0   35    6 o 8.573406 5.076373   2.603757    90.0  0.8720922 1.473535  0.8720922 1.473535 
1 1 1    0   35    7 o 74.55608 1.513951   86.45526    90.0   55.72369 2.255411   55.72369 2.255411 
1 1 1    0   35    8 o 50.91116 1.836321   54.34747   270.0   26.07255 1.864473   26.07255 1.864473 
1 1 1    0   35    9 o 162.7290 2.190758   142.1358   270.0   265.9280 7.127099   265.9280 7.127099 
1 1 1    0   35   10 o 35.44290 3.055516   39.33143    90.0   12.96109 2.135122   12.96109 2.135122 
1 1 1    0   35   11 o 8.970658 5.531536   12.24787   270.0  0.7818757 1.894545  0.7818757 1.894545 
1 1 1    0   35   12 o 34.63544 2.994853   51.69754   270.0   12.41980 2.044906   12.41980 2.044906 
1 1 1    0   35   13 o 25.35330 4.134969   28.42356    90.0   7.006810 1.954689   7.006810 1.954689 
1 1 1    0   35   14 o 18.25381 6.111725   34.12355    90.0   4.540894 1.984761   4.540894 1.984761 
1 1 1    0   35   15 o 52.73677 2.174884   51.72147    90.0   28.35803 2.285483   28.35803 2.285483 
1 1 1    0   35   16 o 15.22391 6.409533   20.89203    90.0   3.668802 1.954689   3.668802 1.954689 
1 1 1    0   35   17 o 7.887051 5.103688   5.688889   270.0  0.5112265 1.834401  0.5112265 1.834401 
1 1 1    0   36    0 o 11.08313 6.238592   1.266345   180.0   1.684040 2.074978   1.684040 2.074978 
1 1 1    0   36    1 o 8.507475 4.971338   5.195079     0.0  0.9021643 1.383319  0.9021643 1.383319 
1 1 1    0   36    2 o 28.33663 2.698414   24.56851   180.0   8.269840 1.503607   8.269840 1.503607 
1 1 1    0   36    3 o 6.542941 4.379855   19.81290   180.0 -0.4210100 1.533679 -0.4210100 1.533679 
1 1 1    0   36    4 o 21.29866 4.100139   4.908772   180.0   5.022048 1.563751   5.022048 1.563751 
1 1 1    0   36    5 f 30.53301 2.648046   15.76528   180.0   9.562942 1.593824   9.562942 1.593824 
1 1 1    0   36    6 o 52.82623 1.797748   33.75691     0.0   28.05731 1.894545   28.05731 1.894545 
1 1 1    0   36    7 o 105.7283 1.536641   84.87979     0.0   112.0187 3.247792   112.0187 3.247792 
1 1 1    0   36    8 o 56.74082 1.725990   42.17038   180.0   32.35763 1.954689   32.35763 1.954689 
1 1 1    0   36    9 o 10.74998 5.997248   10.09438     0.0   1.684040 1.894545   1.684040 1.894545 
1 1 1    0   36   10 o 67.29662 1.902512   67.98695     0.0   45.58937 2.556132   45.58937 2.556132 
1 1 1    0   36   11 o 10.22264 5.937945   10.63493   180.0   1.443463 1.954689   1.443463 1.954689 
1 1 1    0   36   12 f 12.69228 6.355128   11.66053     0.0   2.556132 1.954689   2.556132 1.954689 
1 1 1    0   36   13 o 14.52143 6.529477   22.86992     0.0   3.307936 2.014834   3.307936 2.014834 
1 1 1    0   36   14 o 35.47060 2.877011   43.35542     0.0   13.14153 2.014834   13.14153 2.014834 
1 1 1    0   36   15 o 5.765346 4.122608  0.7253665   180.0  -2.135122 1.954689  -2.135122 1.954689 
1 1 1    0   36   16 o 8.182120 5.219480   1.638290     0.0  0.6315150 1.834401  0.6315150 1.834401 
1 1 1    0   36   17 o 6.429236 4.469687   8.737926   180.0 -0.9021643 1.924617 -0.9021643 1.924617 
1 1 1    0   37    1 f 10.87884 5.504415   24.89838    90.0   1.774257 1.473535   1.774257 1.473535 
1 1 1    0   37    2 o 99.46613 1.527601   91.41830    90.0   99.11779 3.037287   99.11779 3.037287 
1 1 1    0   37    3 o 61.12390 1.675539   41.70711    90.0   37.49996 2.044906   37.49996 2.044906 
1 1 1    0   37    4 o 43.95038 2.027729   41.28976    90.0   19.48675 1.774257   19.48675 1.774257 
1 1 1    0   37    5 o 53.11609 1.759327   63.52817   270.0   28.35803 1.864473   28.35803 1.864473 
1 1 1    0   37    6 o 49.71101 1.820142   51.50067   270.0   24.86966 1.804329   24.86966 1.804329 
1 1 1    0   37    7 o 50.66386 1.815457   32.67805   270.0   25.83197 1.834401   25.83197 1.834401 
1 1 1    0   37    8 o 5.182734 3.669050   18.57223    90.0  -1.473535 1.443463  -1.473535 1.443463 
1 1 1    0   37    9 o 23.33592 5.078614   25.57057   270.0   6.285078 2.074978   6.285078 2.074978 
1 1 1    0   37   10 o 98.03565 1.841933   76.47795    90.0   96.68195 3.608657   96.68195 3.608657 
1 1 1    0   37   11 o 22.85592 5.133925   10.85126    90.0   6.134717 2.044906   6.134717 2.044906 
1 1 1    0   37   12 o 65.15042 1.988877   45.66174    90.0   42.94302 2.586205   42.94302 2.586205 
1 1 1    0   37   13 o 41.39680 2.674369   45.52256   270.0   17.68242 2.195267   17.68242 2.195267 
1 1 1    0   37   14 o 7.642647 5.053319   6.833884   270.0   0.000000 1.924617   0.000000 1.924617 
1 1 1    0   37   15 o 5.207199 3.774222   7.388037    90.0  -2.916998 1.924617  -2.916998 1.924617 
1 1 1    0   37   16 o 7.315685 4.922338   12.43984   270.0 -0.1202886 1.984761 -0.1202886 1.984761 
1 1 1    0   38    0 o 81.33675 1.906405   28.29737   360.0   66.33915 3.097431   66.33915 3.097431 
1 1 1    0   38    1 o 44.89964 1.814788   28.60487   180.0   20.29870 1.623896   20.29870 1.623896 
1 1 1    0   38    2 o 8.303141 5.001766   36.33171   180.0  0.7518036 1.473535  0.7518036 1.473535 
1 1 1    0   38    3 o 127.2798 1.666330   132.9452   180.0   162.3595 4.240172   162.3595 4.240172 
1 1 1    0   38    4 o 92.14788 1.453051   93.87948   180.0   85.10417 2.676421   85.10417 2.676421 
1 1 1    0   38    5 o 71.03264 1.504419   61.76239   180.0   50.61142 2.135122   50.61142 2.135122 
1 1 1    0   38    6 o 6.259913 4.250312   3.875500     0.0 -0.6315150 1.533679 -0.6315150 1.533679 
1 1 1    0   38    7 o 93.75426 1.540554   63.51877     0.0   88.20160 2.886926   88.20160 2.886926 
1 1 1    0   38    8 o 50.25996 1.860387   13.59893     0.0   25.47111 1.864473   25.47111 1.864473 
1 1 1    0   38    9 o 83.41857 1.858612   78.34982     0.0   70.03802 3.097431   70.03802 3.097431 
1 1 1    0   38   10 o 25.26410 4.422185   16.56998     0.0   7.066954 2.044906   7.066954 2.044906 
1 1 1    0   38   11 o 59.23918 2.086986   46.99503     0.0   35.54527 2.465916   35.54527 2.465916 
1 1 1    0   38   12 o 18.97451 5.896124   3.695015   180.0   4.751399 1.954689   4.751399 1.954689 
1 1 1    0   38   13 o 17.50991 6.622321   13.64002   180.0   4.510822 2.165194   4.510822 2.165194 
1 1 1    0   38   14 o 7.427848 4.997364   6.447269     0.0 -0.3007214 2.044906 -0.3007214 2.044906 
1 1 1    0   38   15 o 24.54869 5.229617   22.20459     0.0   7.427820 2.255411   7.427820 2.255411 
1 1 1    0   38   16 o 7.115782 4.846249   5.314139   180.0 -0.3007214 2.014834 -0.3007214 2.014834 
1 1 1    0   39    1 o 56.40710 1.655841   32.78686    90.0   31.96669 1.864473   31.96669 1.864473 
1 1 1    0   39    2 o 5.028169 3.583710   9.035900   270.0  -1.684040 1.443463  -1.684040 1.443463 
1 1 1    0   39    3 o 77.55896 1.494007   58.54720    90.0   60.32472 2.315555   60.32472 2.315555 
1 1 1    0   39    4 o 87.33465 1.516083   84.59351   270.0   76.50353 2.646349   76.50353 2.646349 
1 1 1    0   39    5 o 48.71033 1.795686   36.59307   270.0   23.90735 1.744184   23.90735 1.744184 
1 1 1    0   39    6 o 35.65878 2.210187   16.67439   270.0   12.93102 1.563751   12.93102 1.563751 
1 1 1    0   39    7 o 35.57357 2.302202   33.27821   270.0   12.90095 1.623896   12.90095 1.623896 
1 1 1    0   39    8 f 12.73527 5.856598   18.02708    90.0   2.465916 1.623896   2.465916 1.623896 
1 1 1    0   39    9 o 29.37304 3.405150   50.08300    90.0   9.141932 1.954689   9.141932 1.954689 
1 1 1    0   39   10 o 51.17224 2.331667   45.25094   270.0   26.64392 2.375700   26.64392 2.375700 
1 1 1    0   39   11 o 8.275218 5.324667   8.609101   270.0  0.3909379 1.954689  0.3909379 1.954689 
1 1 1    0   39   12 o 17.37516 6.386847   25.60329    90.0   4.360461 2.044906   4.360461 2.044906 
1 1 1    0   39   13 o 10.24720 6.043708  0.1735830   270.0   1.623896 2.074978   1.623896 2.074978 
1 1 1    0   39   14 o 8.183989 5.300340   5.117456    90.0  0.4811543 1.984761  0.4811543 1.984761 
1 1 1    0   39   15 f 5.780507 4.123930   4.782238   270.0  -1.774257 1.924617  -1.774257 1.924617 
1 1 1    0   40    0 o 55.28554 2.375611   51.46797     0.0   30.82395 2.616277   30.82395 2.616277 
1 1 1    0   40    1 o 50.29831 1.738386   35.89660     0.0   25.47111 1.744184   25.47111 1.744184 
1 1 1    0   40    2 o 13.55963 5.609237   16.02356     0.0   2.646349 1.503607   2.646349 1.503607 
1 1 1    0   40    3 o 11.84099 5.462828   31.48147     0.0   2.105050 1.413391   2.105050 1.413391 
1 1 1    0   40    4 o 50.66891 1.785356   41.58850   180.0   25.86205 1.804329   25.86205 1.804329 
1 1 1    0   40    5 o 15.10973 5.446239   4.321846     0.0   3.097431 1.503607   3.097431 1.503607 
1 1 1    0   40    6 f 65.50116 1.655134   43.79621   180.0   43.15353 2.165194   43.15353 2.165194 
1 1 1    0   40    7 o 27.21099 2.816955   28.76620     0.0   7.728541 1.503607   7.728541 1.503607 
1 1 1    0   40    8 o 90.93272 1.489077   95.24197     0.0   83.08933 2.706493   83.08933 2.706493 
1 1 1    0   40    9 o 28.14062 3.679889   37.00274   180.0   8.540489 2.014834   8.540489 2.014834 
1 1 1    0   40   10 o 24.99881 4.758117   25.02516   180.0   7.157170 2.135122   7.157170 2.135122 
1 1 1    0   40   11 o 18.10895 6.406493   5.812950   180.0   4.661182 2.105050   4.661182 2.105050 
1 1 1    0   40   12 o 39.66777 2.990315   25.18970   180.0   16.47953 2.345627   16.47953 2.345627 
1 1 1    0   40   13 o 10.04009 5.915744   6.186304     0.0   1.623896 1.984761   1.623896 1.984761 
1 1 1    0   40   14 o 8.258709 5.303494   1.483304   180.0  0.7217315 1.924617  0.7217315 1.924617 
1 1 1    0   41    1 o 93.17974 1.469251   68.69234    90.0   87.11900 2.736565   87.11900 2.736565 
1 1 1    0   41    2 o 49.74891 1.849229   48.94098    90.0   24.95988 1.834401   24.95988 1.834401 
1 1 1    0   41    3 o 36.03746 2.271646   14.33057    90.0   13.23174 1.623896   13.23174 1.623896 
1 1 1    0   41    4 o 29.40123 2.755534   36.34430   270.0   8.961499 1.593824   8.961499 1.593824 
1 1 1    0   41    5 o 11.93995 5.725871   7.471104    90.0   2.195267 1.563751   2.195267 1.563751 
1 1 1    0   41    6 o 30.37006 2.611475   41.55728   270.0   9.532870 1.563751   9.532870 1.563751 
1 1 1    0   41    7 o 57.65105 1.698528   51.82484   270.0   33.50037 1.954689   33.50037 1.954689 
1 1 1    0   41    8 o 68.81929 1.596861   68.96585    90.0   47.72449 2.195267   47.72449 2.195267 
1 1 1    0   41    9 o 9.752761 5.789346   8.965064    90.0   1.323174 1.924617   1.323174 1.924617 
1 1 1    0   41   10 o 7.011235 4.837669  0.5705249    90.0 -0.9923807 2.135122 -0.9923807 2.135122 
1 1 1    0   41   11 o 10.15899 5.996068   1.086653   270.0   1.563751 2.044906   1.563751 2.044906 
1 1 1    0   41   12 o 9.737661 6.020148   2.352620   270.0   1.323174 2.255411   1.323174 2.255411 
1 1 1    0   41   13 o 6.050729 4.309031   3.879436    90.0  -1.834401 2.074978  -1.834401 2.074978 
1 1 1    0   41   14 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1    0   42    0 f 123.3446 2.550200   104.3728     0.0   153.0672 6.285078   153.0672 6.285078 
1 1 1    0   42    1 o 21.64632 3.997706   17.15816   180.0   5.202481 1.563751   5.202481 1.563751 
1 1 1    0   42    2 o 7.113815 4.626853   22.20398   180.0       0.06 1.533679       0.06 1.533679 
1 1 1    0   42    3 o 11.68174 5.613291   3.686347   180.0   2.105050 1.503607   2.105050 1.503607 
1 1 1    0   42    4 o 6.194031 4.191027   5.910632   180.0 -0.5112265 1.473535 -0.5112265 1.473535 
1 1 1    0   42    5 o 18.21621 4.972999  0.5022928   360.0   4.089812 1.563751   4.089812 1.563751 
1 1 1    0   42    6 o 6.141862 4.184277   11.62559   180.0 -0.6014429 1.503607 -0.6014429 1.503607 
1 1 1    0   42    7 o 7.496246 4.799677   3.758888   180.0  0.3307936 1.563751  0.3307936 1.563751 
1 1 1    0   42    8 o 42.97492 2.110118   44.77660   180.0   18.82516 1.804329   18.82516 1.804329 
1 1 1    0   42    9 o 23.02308 5.417989   35.06689   180.0   6.465511 2.165194   6.465511 2.165194 
1 1 1    0   42   10 o 8.554643 5.511792   2.309159   180.0  0.5112265 2.105050  0.5112265 2.105050 
1 1 1    0   42   11 o 14.27393 6.707249   18.83150     0.0   3.488369 2.135122   3.488369 2.135122 
1 1 1    0   42   12 o 51.34999 2.412481   33.21706     0.0   27.36565 2.465916   27.36565 2.465916 
1 1 1    0   42   13 o 6.786533 4.665535   8.375741   180.0 -0.5412986 1.954689 -0.5412986 1.954689 
1 1 1    0   43    1 o 19.07536 4.741764   20.88103    90.0   4.360461 1.563751   4.360461 1.563751 
1 1 1    0   43    2 o 13.61981 5.604940   14.12473   270.0   2.706493 1.503607   2.706493 1.503607 
1 1 1    0   43    3 o 7.584608 4.746469   8.255736   270.0  0.4811543 1.443463  0.4811543 1.443463 
1 1 1    0   43    4 o 51.68428 1.808558   49.17065    90.0   27.00479 1.864473   27.00479 1.864473 
1 1 1    0   43    5 o 31.62783 2.502842   35.11411   270.0   10.34482 1.563751   10.34482 1.563751 
1 1 1    0   43    6 o 47.08227 2.019974   30.54961   270.0   22.52404 1.894545   22.52404 1.894545 
1 1 1    0   43    7 o 12.16812 5.786658   17.30635    90.0   2.375700 1.593824   2.375700 1.593824 
1 1 1    0   43    8 o 14.33911 5.614253   12.92411   270.0   3.007215 1.533679   3.007215 1.533679 
1 1 1    0   43    9 o 13.15855 6.554370   7.328077   270.0   2.947070 2.074978   2.947070 2.074978 
1 1 1    0   43   10 o 36.69785 2.946143   23.90485   270.0   14.22412 2.135122   14.22412 2.135122 
1 1 1    0   43   11 o 8.863882 5.662125   3.598134   270.0  0.9021643 2.165194  0.9021643 2.165194 
1 1 1    0   43   12 o 11.06853 6.320326   7.525752    90.0   2.345627 2.165194   2.345627 2.165194 
1 1 1    0   44    0 o 8.252719 5.357568   3.099352   180.0  0.1202886 2.044906  0.1202886 2.044906 
1 1 1    0   44    1 o 7.161770 4.645632   14.78217   180.0  0.1503607 1.533679  0.1503607 1.533679 
1 1 1    0   44    2 o 68.65031 1.600810   58.49961     0.0   47.51399 2.195267   47.51399 2.195267 
1 1 1    0   44    3 f 8.125842 4.968829  0.4490944     0.0  0.7518036 1.503607  0.7518036 1.503607 
1 1 1    0   44    4 o 10.30299 5.586640   26.10842     0.0   1.684040 1.593824   1.684040 1.593824 
1 1 1    0   44    5 o 25.42903 3.154288   22.06662   180.0   6.946666 1.563751   6.946666 1.563751 
1 1 1    0   44    6 o 28.60576 2.671592   19.76366   180.0   8.570561 1.503607   8.570561 1.503607 
1 1 1    0   44    7 o 72.47828 1.599145   45.52304     0.0   53.04726 2.315555   53.04726 2.315555 
1 1 1    0   44    8 o 12.80059 5.858228   6.195397     0.0   2.646349 1.623896   2.646349 1.623896 
1 1 1    0   44    9 o 9.223208 5.738757   1.641016   180.0   1.112669 2.074978   1.112669 2.074978 
1 1 1    0   44   10 o 9.345005 5.797003   7.438633     0.0   1.293102 2.105050   1.293102 2.105050 
1 1 1    0   44   11 o 6.786263 4.788747   4.757597     0.0  -1.503607 2.405771  -1.503607 2.405771 
1 1 1    0   45    1 o 65.66585 1.627968   54.26324   270.0   43.54447 2.135122   43.54447 2.135122 
1 1 1    0   45    2 o 11.28986 5.679128   12.25432   270.0   2.074978 1.563751   2.074978 1.563751 
1 1 1    0   45    3 o 12.38113 5.744216   12.50464   270.0   2.435844 1.563751   2.435844 1.563751 
1 1 1    0   45    4 o 13.31062 5.807357   16.66177   270.0   2.736565 1.593824   2.736565 1.593824 
1 1 1    0   45    5 o 26.35814 3.156078   28.81478    90.0   7.457891 1.623896   7.457891 1.623896 
1 1 1    0   45    6 o 6.949429 4.612610   6.458121   270.0      -0.06 1.623896      -0.06 1.623896 
1 1 1    0   45    7 o 26.13701 3.307369   16.81492   270.0   7.457891 1.684040   7.457891 1.684040 
1 1 1    0   45    8 o 11.55356 5.344515   2.977655   270.0   2.165194 1.353247   2.165194 1.353247 
1 1 1    0   45    9 o 43.87516 2.694071   29.24950   270.0   20.26863 2.345627   20.26863 2.345627 
1 1 1    0   45   10 o 6.272005 4.438032   3.222440    90.0  -1.503607 2.105050  -1.503607 2.105050 
1 1 1    0   46    0 o 90.24734 2.051656   86.85886   180.0   82.12703 3.698874   82.12703 3.698874 
1 1 1    0   46    1 o 43.28209 2.235980   39.11063     0.0   19.18603 1.924617   19.18603 1.924617 
1 1 1    0   46    2 f 7.337736 4.751382   25.16115   180.0  0.2405772 1.593824  0.2405772 1.593824 
1 1 1    0   46    3 o 13.73713 5.662012   16.10287     0.0   2.856854 1.533679   2.856854 1.533679 
1 1 1    0   46    4 o 5.572686 3.889916   11.75768   180.0  -1.052525 1.503607  -1.052525 1.503607 
1 1 1    0   46    5 o 7.067827 4.627122   4.940266     0.0  0.1503607 1.563751  0.1503607 1.563751 
1 1 1    0   46    6 o 6.936236 4.619159   3.568817   180.0      -0.06 1.653968      -0.06 1.653968 
1 1 1    0   46    7 o 25.77415 3.314918   27.01818     0.0   7.127099 1.714112   7.127099 1.714112 
1 1 1    0   46    8 o 23.46493 4.045638   19.93359   180.0   6.375295 1.744184   6.375295 1.744184 
1 1 1    0   47    1 o 62.36616 1.860067   33.91692   270.0   39.57494 2.315555   39.57494 2.315555 
1 1 1    0   47    2 o 60.83028 1.708525   39.95722   270.0   37.56011 2.074978   37.56011 2.074978 
1 1 1    0   47    3 o 21.23667 4.414648   31.85954    90.0   5.352841 1.653968   5.352841 1.653968 
1 1 1    0   47    4 o 27.63127 3.230947   20.04079    90.0   8.299912 1.744184   8.299912 1.744184 
1 1 1    0   47    5 o 7.017987 4.656980   9.206470   270.0       0.06 1.653968       0.06 1.653968 
1 1 1    0   47    6 o 47.56086 2.223409   31.48826   270.0   23.42620 2.105050   23.42620 2.105050 
1 1 1    0   47    7 f 10.61057 5.850583   2.591042   270.0   2.074978 1.774257   2.074978 1.774257 
1 1 1    0   48    0 o 6.614361 4.622244   10.95373     0.0  -1.533679 2.135122  -1.533679 2.135122 
1 1 1    0   48    1 o 22.76487 3.964360   11.08142   180.0   5.954284 1.653968   5.954284 1.653968 
1 1 1    0   48    2 o 7.863888 4.966046   17.52562     0.0  0.6916593 1.623896  0.6916593 1.623896 
1 1 1    0   48    3 o 40.42448 2.170528   34.83614     0.0   16.93062 1.744184   16.93062 1.744184 
1 1 1    0   48    4 o 9.248274 5.204318   3.246339   180.0   1.473535 1.443463   1.473535 1.443463 
1 1 1    0   48    5 o 10.66296 5.717202   6.891001   180.0   2.074978 1.653968   2.074978 1.653968 
1 1 1    0   49    1 o 35.60762 2.473290   24.81671    90.0   13.35203 1.744184   13.35203 1.744184 
1 1 1    0   49    2 o 5.861187 4.088030  0.2745704    90.0 -0.9322364 1.653968 -0.9322364 1.653968 
1 1 1    1    0    1 o 257.8593 4.265154          ?       ?   666.5792 21.98274   666.5792 21.98274 
1 1 1    1    0    2 o 160.8802 1.720129   342.6785   270.0   258.9512 5.533275   258.9512 5.533275 
1 1 1    1    0    3 o 286.0045 2.445040   366.5311   270.0   818.2932 13.98355   818.2932 13.98355 
1 1 1    1    0    4 o 261.4301 2.335515   66.64188    90.0   683.6902 12.20929   683.6902 12.20929 
1 1 1    1    0    5 o 29.65784 0.7106848   192.4063   270.0   8.811138 0.4210100   8.811138 0.4210100 
1 1 1    1    0    6 o 179.8706 1.714023   296.6507    90.0   323.6665 6.164790   323.6665 6.164790 
1 1 1    1    0    7 o 83.70125 1.096224   40.26085    90.0   70.09817 1.834401   70.09817 1.834401 
1 1 1    1    0    8 f 162.7475 1.644901   283.6129    90.0   264.9657 5.352841   264.9657 5.352841 
1 1 1    1    0    9 o 76.45522 1.082144   63.73979   270.0   58.49032 1.653968   58.49032 1.653968 
1 1 1    1    0   10 o 47.16029 1.181311   153.5192    90.0   22.28346 1.112669   22.28346 1.112669 
1 1 1    1    0   11 o 110.6460 1.617907   25.31218    90.0   122.5139 3.578585   122.5139 3.578585 
1 1 1    1    0   12 o 159.7124 2.005991   89.99873   270.0   255.2524 6.405366   255.2524 6.405366 
1 1 1    1    0   13 o 33.76838 1.655986   1.517545    90.0   11.48756 1.112669   11.48756 1.112669 
1 1 1    1    0   14 o 136.6570 1.683998   106.4293   270.0   186.8984 4.601038   186.8984 4.601038 
1 1 1    1    0   15 o 76.44242 1.476464   87.93599    90.0   58.52040 2.255411   58.52040 2.255411 
1 1 1    1    0   16 o 20.22137 4.010792   37.09755    90.0   4.540894 1.443463   4.540894 1.443463 
1 1 1    1    0   17 o 82.14323 1.593848   81.15958    90.0   67.60218 2.616277   67.60218 2.616277 
1 1 1    1    0   18 f 76.44041 1.555390   76.67654   270.0   58.55046 2.375700   58.55046 2.375700 
1 1 1    1    0   19 o 25.51768 2.954667   26.90721    90.0   6.796305 1.473535   6.796305 1.473535 
1 1 1    1    0   20 o 55.38008 1.714108   68.91592   270.0   30.82395 1.894545   30.82395 1.894545 
1 1 1    1    0   21 o 19.69082 4.063359   54.56125   270.0   4.390533 1.413391   4.390533 1.413391 
1 1 1    1    0   22 o 8.550552 5.070222   2.639058    90.0  0.9322364 1.473535  0.9322364 1.473535 
1 1 1    1    0   23 o 21.50237 4.335777   6.347423   270.0   5.322770 1.653968   5.322770 1.653968 
1 1 1    1    0   24 o 9.264645 5.370629   6.708176    90.0   1.323174 1.593824   1.323174 1.593824 
1 1 1    1    0   25 x        ?      ?   23.73731   270.0          ?        ?          ?        ? 
1 1 1    1    1    0 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1    1    1    1 o 143.6928 2.584617   2211.740   298.2   206.7159 7.427820          ?        ? 
1 1 1    1    1    2 o 161.7725 1.338419   518.0691   202.0   261.7480 4.330389          ?        ? 
1 1 1    1    1    3 o 458.6106 3.091734   1215.736    80.1   2104.268 28.35803          ?        ? 
1 1 1    1    1    4 o 267.5244 1.776062   398.3962    67.7   715.7772 9.502798          ?        ? 
1 1 1    1    1    5 o 234.8472 1.619831   329.8008   317.0   551.6133 7.608253          ?        ? 
1 1 1    1    1    6 o 101.6023 0.8731377   90.07592   165.9   103.2377 1.774257          ?        ? 
1 1 1    1    1    7 o 217.2531 1.543381   224.4314   229.2   472.0725 6.706088          ?        ? 
1 1 1    1    1    8 o 332.5504 2.170292   354.7183   210.3   1106.144 14.43463          ?        ? 
1 1 1    1    1    9 o 412.7873 2.695503   404.4413   252.7   1704.369 22.25339          ?        ? 
1 1 1    1    1   10 o 486.4055 3.097445   552.6135   299.4   2366.918 30.13229          ?        ? 
1 1 1    1    1   11 o 224.7679 1.745985   237.9168    89.8   505.3023 7.848830          ?        ? 
1 1 1    1    1   12 o 11.26170 3.275602   53.63270   341.5   1.293102 0.7818757          ?        ? 
1 1 1    1    1   13 o 78.12624 0.9815393   130.1808   106.8   61.04646 1.533679          ?        ? 
1 1 1    1    1   14 o 41.82927 1.114335   55.65588   336.8   17.50199 0.9322364          ?        ? 
1 1 1    1    1   15 o 143.0503 1.387457   126.6346    49.5   204.7612 3.969523          ?        ? 
1 1 1    1    1   16 f 61.78701 0.9734132   94.65427   324.7   38.19162 1.202886          ?        ? 
1 1 1    1    1   17 o 71.49476 1.114644   80.64881   100.7   51.15272 1.593824          ?        ? 
1 1 1    1    1   18 o 56.00574 1.181285   73.42110   117.4   31.39532 1.323174          ?        ? 
1 1 1    1    1   19 o 78.42958 1.131114   93.24412   105.8   61.58775 1.774257          ?        ? 
1 1 1    1    1   20 o 20.71043 2.541051   5.243206    81.2   4.330389 1.052525          ?        ? 
1 1 1    1    1   21 o 38.77948 1.589704   36.59689   294.0   15.12629 1.232958          ?        ? 
1 1 1    1    1   22 o 40.28979 1.642071   36.28269    69.9   16.38932 1.323174          ?        ? 
1 1 1    1    1   23 x        ?      ?   11.04681   235.3          ?        ?          ?        ? 
1 1 1    1    1   24 x        ?      ?   25.55622   195.1          ?        ?          ?        ? 
1 1 1    1    1   25 x        ?      ?   39.20797   266.5          ?        ?          ?        ? 
1 1 1    1    2    0 o 250.9385 4.160962   5514.752   180.0   631.2143 20.87007   631.2143 20.87007 
1 1 1    1    2    1 f 92.30518 1.335741   2679.184   346.9   85.22446 2.465916          ?        ? 
1 1 1    1    2    2 o 60.79174 0.8656811   447.3405   220.5   36.95867 1.052525          ?        ? 
1 1 1    1    2    3 o 142.2982 1.363091   340.4301   343.5   202.5058 3.879307          ?        ? 
1 1 1    1    2    4 o 280.6530 2.169800   509.7210     1.7   787.8000 12.17922          ?        ? 
1 1 1    1    2    5 o 188.5367 1.563128   217.1078   357.2   355.5129 5.894140          ?        ? 
1 1 1    1    2    6 o 158.9525 1.258110   88.66734   199.7   252.6962 3.999595          ?        ? 
1 1 1    1    2    7 o 454.1653 3.078956   571.2894    12.5   2064.092 27.96709          ?        ? 
1 1 1    1    2    8 o 524.7671 3.555819   767.3292    10.4   2755.390 37.31953          ?        ? 
1 1 1    1    2    9 o 326.8279 2.341710   402.3252   267.2   1068.373 15.30672          ?        ? 
1 1 1    1    2   10 o 376.7850 2.677709   452.9820   305.8   1420.127 20.17841          ?        ? 
1 1 1    1    2   11 o 358.2973 3.185170   400.2617    28.5   1284.592 22.82476          ?        ? 
1 1 1    1    2   12 o 186.8393 1.496853   222.8960   146.7   349.1677 5.593419          ?        ? 
1 1 1    1    2   13 o 195.5262 1.568771   249.9814   149.0   382.4576 6.134717          ?        ? 
1 1 1    1    2   14 o 67.91285 0.9077500   49.58231   142.3   46.13067 1.232958          ?        ? 
1 1 1    1    2   15 o 82.24603 0.9140910   91.44962   294.5   67.66232 1.503607          ?        ? 
1 1 1    1    2   16 o 72.50578 1.057625   60.01466   131.9   52.59618 1.533679          ?        ? 
1 1 1    1    2   17 o 51.83070 1.131389   62.23615   119.9   26.88450 1.172814          ?        ? 
1 1 1    1    2   18 f 70.58164 1.129064   74.39745   164.9   49.85962 1.593824          ?        ? 
1 1 1    1    2   19 o 65.53524 1.147175   50.40956   139.8   43.00317 1.503607          ?        ? 
1 1 1    1    2   20 o 25.89099 1.800311   33.41777   257.2   6.736160 0.9322364          ?        ? 
1 1 1    1    2   21 o 20.47008 2.864702   14.27494    92.9   4.270245 1.172814          ?        ? 
1 1 1    1    2   22 x        ?      ?   15.20985    43.1          ?        ?          ?        ? 
1 1 1    1    2   23 o 14.92919 5.398919   18.10256    81.7   2.405771 2.074978          ?        ? 
1 1 1    1    2   24 x        ?      ?   14.95383   166.1          ?        ?          ?        ? 
1 1 1    1    2   25 x        ?      ?   12.14303   271.3          ?        ?          ?        ? 
1 1 1    1    3    0 o 23.82410 0.5054094   1516.651   180.0   5.683635 0.2405772   5.683635 0.2405772 
1 1 1    1    3    1 o 261.5801 2.057845   908.2028   126.3   684.5623 10.76583          ?        ? 
1 1 1    1    3    2 o 168.1742 1.296412   491.9183   228.1   282.8586 4.360461          ?        ? 
1 1 1    1    3    3 o 383.2234 3.205564   757.9756   272.7   1469.265 24.56894          ?        ? 
1 1 1    1    3    4 o 355.7196 2.992678   640.8396   279.1   1265.797 21.29108          ?        ? 
1 1 1    1    3    5 o 448.1991 3.693608   287.8667   294.6   2010.654 33.10943          ?        ? 
1 1 1    1    3    6 o 155.2471 1.375306   176.7768   254.9   241.0583 4.270245          ?        ? 
1 1 1    1    3    7 o 239.7536 1.787369   329.6087    98.1   574.9493 8.570561          ?        ? 
1 1 1    1    3    8 o 420.7217 2.901987   612.5151    89.0   1770.708 24.41858          ?        ? 
1 1 1    1    3    9 o 176.0558 1.554374   225.9070    47.8   309.9837 5.473131          ?        ? 
1 1 1    1    3   10 o 130.7009 1.276965   141.1165   128.6   170.8398 3.338008          ?        ? 
1 1 1    1    3   11 o 357.9213 2.755819   396.0363   314.6   1281.705 19.72733          ?        ? 
1 1 1    1    3   12 o 102.6601 1.054545   107.6397   224.2   105.4029 2.165194          ?        ? 
1 1 1    1    3   13 o 104.7286 1.105503   149.5534   306.5   109.7032 2.315555          ?        ? 
1 1 1    1    3   14 o 93.01986 0.9860265   167.1817   253.1   86.54763 1.834401          ?        ? 
1 1 1    1    3   15 o 206.4529 1.587706   231.6529   255.9   426.5734 6.555727          ?        ? 
1 1 1    1    3   16 o 105.4293 1.041109   127.0289    22.8   111.2068 2.195267          ?        ? 
1 1 1    1    3   17 o 33.92018 1.329834   31.66435    51.2   11.51763 0.9021643          ?        ? 
1 1 1    1    3   18 o 79.96764 1.034148   92.24729   110.8   63.99353 1.653968          ?        ? 
1 1 1    1    3   19 o 71.46191 1.052034   78.78748    75.1   51.12265 1.503607          ?        ? 
1 1 1    1    3   20 o 39.84261 1.622763   40.39419    94.6   15.93824 1.293102          ?        ? 
1 1 1    1    3   21 o 57.88006 1.376833   61.71731    56.0   33.65073 1.593824          ?        ? 
1 1 1    1    3   22 o 12.32352 5.159067   27.60385   292.8  0.6315150 2.135122          ?        ? 
1 1 1    1    3   23 o 44.22158 1.734085   50.05991   282.0   19.87769 1.533679          ?        ? 
1 1 1    1    3   24 o 48.51277 1.673679   45.80534   299.4   24.05772 1.623896          ?        ? 
1 1 1    1    3   25 o 10.77932 4.572559   12.42806   167.7  0.9021643 1.714112          ?        ? 
1 1 1    1    4    0 o 25.11242 0.5394294   446.4013   180.0   6.315150 0.2706493   6.315150 0.2706493 
1 1 1    1    4    1 o 63.76236 0.5895356   469.0974   270.9   40.65754 0.7518036          ?        ? 
1 1 1    1    4    2 o 117.7391 0.9833414   192.4915   134.6   138.6326 2.315555          ?        ? 
1 1 1    1    4    3 o 237.4409 2.115073   123.9852   347.5   563.8828 10.04410          ?        ? 
1 1 1    1    4    4 o 269.2406 2.362295   351.3096   143.3   725.0695 12.72052          ?        ? 
1 1 1    1    4    5 o 184.2060 1.714155   146.2975   133.5   339.3942 6.315150          ?        ? 
1 1 1    1    4    6 o 246.3781 2.172612   414.8445    13.3   607.2769 10.70568          ?        ? 
1 1 1    1    4    7 o 135.5770 1.242128   71.41205   134.5   183.8310 3.368080          ?        ? 
1 1 1    1    4    8 o 226.9232 1.895053   235.7641   232.6   515.0156 8.600634          ?        ? 
1 1 1    1    4    9 o 237.3749 1.988975   414.9884   120.6   563.5520 9.442654          ?        ? 
1 1 1    1    4   10 o 395.4137 2.779714   465.3608   146.4   1564.082 21.98274          ?        ? 
1 1 1    1    4   11 o 189.8519 1.671098   171.2101    88.1   360.5049 6.345222          ?        ? 
1 1 1    1    4   12 o 148.7901 1.263195   179.9420    63.0   221.4212 3.759018          ?        ? 
1 1 1    1    4   13 o 129.0701 1.164954   115.5453   266.5   166.6297 3.007215          ?        ? 
1 1 1    1    4   14 o 162.3437 1.333710   176.2198   115.3   263.6725 4.330389          ?        ? 
1 1 1    1    4   15 o 103.6828 1.029642   126.9287   226.1   107.5380 2.135122          ?        ? 
1 1 1    1    4   16 o 155.6827 1.303850   179.3498   238.4   242.5619 4.059740          ?        ? 
1 1 1    1    4   17 o 77.93813 0.9646159   67.31400    43.9   60.77581 1.503607          ?        ? 
1 1 1    1    4   18 o 33.96191 1.328200   28.63569   171.0   11.54770 0.9021643          ?        ? 
1 1 1    1    4   19 o 121.9309 1.134511   132.4448   214.5   148.8571 2.766637          ?        ? 
1 1 1    1    4   20 o 24.19965 2.050404   11.95923    73.4   5.894140 0.9923807          ?        ? 
1 1 1    1    4   21 o 37.29993 1.975252   27.74052   158.2   14.04369 1.473535          ?        ? 
1 1 1    1    4   22 o 55.11072 1.473303   61.97697   201.9   30.61344 1.623896          ?        ? 
1 1 1    1    4   23 o 13.29059 4.229085   10.55496   211.3   1.954689 1.263030          ?        ? 
1 1 1    1    4   24 o 9.029074 4.158887   9.901874   140.1 -0.7818757 1.744184          ?        ? 
1 1 1    1    4   25 o 8.940210 4.065795   14.15605   338.4 -0.2405772 1.593824          ?        ? 
1 1 1    1    5    0 o 67.07655 0.8970109   276.3112   180.0   45.01800 1.202886   45.01800 1.202886 
1 1 1    1    5    1 o 271.0387 1.736391   684.2296   100.3   734.7527 9.412581          ?        ? 
1 1 1    1    5    2 o 203.4146 1.581853   146.1890   116.1   413.8228 6.435439          ?        ? 
1 1 1    1    5    3 o 38.07172 0.6319052   38.27527   244.2   14.49477 0.4811543          ?        ? 
1 1 1    1    5    4 o 200.5146 1.844690   451.4394   225.3   402.1247 7.397748          ?        ? 
1 1 1    1    5    5 o 125.6888 1.280034   147.0417   164.6   157.9991 3.217719          ?        ? 
1 1 1    1    5    6 o 131.0402 1.353979   187.5981   220.9   171.7420 3.548513          ?        ? 
1 1 1    1    5    7 o 205.4464 1.895552   286.1560   121.9   422.1829 7.788685          ?        ? 
1 1 1    1    5    8 o 249.0282 2.258174   344.4317    77.9   620.2681 11.24698          ?        ? 
1 1 1    1    5    9 o 200.8565 1.676859   264.5888    76.9   403.4780 6.736160          ?        ? 
1 1 1    1    5   10 o 94.28053 1.084479   78.71918   263.4   88.89326 2.044906          ?        ? 
1 1 1    1    5   11 o 177.1144 1.460189   162.8958    66.8   313.7427 5.172409          ?        ? 
1 1 1    1    5   12 o 95.04002 1.059992   94.42730   178.2   90.33672 2.014834          ?        ? 
1 1 1    1    5   13 o 286.0392 2.113172   309.1929   184.7   818.8344 12.08900          ?        ? 
1 1 1    1    5   14 o 49.92313 1.024027   58.85115   146.3   24.92981 1.022453          ?        ? 
1 1 1    1    5   15 o 66.92850 0.9435667   85.65011   232.4   44.80750 1.263030          ?        ? 
1 1 1    1    5   16 o 64.75307 1.021708   40.80504   175.6   41.95064 1.323174          ?        ? 
1 1 1    1    5   17 o 56.70884 1.007551   55.30665   312.4   32.17720 1.142741          ?        ? 
1 1 1    1    5   18 o 80.58804 0.9702132   88.88495   137.4   64.98591 1.563751          ?        ? 
1 1 1    1    5   19 o 29.54595 1.577605   43.99537   143.1   8.750995 0.9322364          ?        ? 
1 1 1    1    5   20 o 39.34680 1.222855   55.50440    96.3   15.51723 0.9623086          ?        ? 
1 1 1    1    5   21 o 23.52300 2.556829   21.79533   102.4   5.623491 1.202886          ?        ? 
1 1 1    1    5   22 o 14.48127 3.718949   20.65085   236.1   2.285483 1.082597          ?        ? 
1 1 1    1    5   23 o 9.323188 3.988083   2.925251   103.5  0.1804329 1.323174          ?        ? 
1 1 1    1    5   24 o 18.11505 4.630208   19.35118   220.5   3.999595 1.684040          ?        ? 
1 1 1    1    5   25 o 14.92135 5.181823   17.72774   267.8   3.097431 1.894545          ?        ? 
1 1 1    1    6    0 o 83.68159 1.150452   549.2561   180.0   70.06810 1.924617   70.06810 1.924617 
1 1 1    1    6    1 o 543.0914 4.587584   1111.130   140.1   2952.363 49.82954          ?        ? 
1 1 1    1    6    2 o 255.3548 1.801822   606.7545    73.3   652.1445 9.202076          ?        ? 
1 1 1    1    6    3 o 225.2442 1.722267   129.5140    67.1   507.4073 7.758613          ?        ? 
1 1 1    1    6    4 o 64.41898 0.7935960   38.68352   333.7   41.49956 1.022453          ?        ? 
1 1 1    1    6    5 o 175.1335 1.665586   150.8505     4.5   306.7960 5.833996          ?        ? 
1 1 1    1    6    6 o 528.0967 4.336316   515.9276    54.9   2793.041 45.79988          ?        ? 
1 1 1    1    6    7 o 257.5691 2.300048   294.2754   323.4   663.6321 11.84843          ?        ? 
1 1 1    1    6    8 o 283.4405 2.472057   342.0299   266.0   803.5578 14.01362          ?        ? 
1 1 1    1    6    9 o 542.8683 3.935809   663.4607   181.0   2948.965 42.73252          ?        ? 
1 1 1    1    6   10 o 181.2604 1.625876   162.2782   348.0   328.5983 5.894140          ?        ? 
1 1 1    1    6   11 o 45.41784 1.026289   49.13902   311.3   20.62949 0.9322364          ?        ? 
1 1 1    1    6   12 o 159.1751 1.360260   125.9183   159.4   253.4180 4.330389          ?        ? 
1 1 1    1    6   13 o 73.99506 0.9347373   69.39694    46.7   54.76138 1.383319          ?        ? 
1 1 1    1    6   14 f 174.7596 1.411033   211.2554   312.0   305.5630 4.931832          ?        ? 
1 1 1    1    6   15 o 40.39976 1.153765   43.01990   127.7   16.32917 0.9322364          ?        ? 
1 1 1    1    6   16 o 144.4518 1.249087   161.7237   345.6   208.8210 3.608657          ?        ? 
1 1 1    1    6   17 o 39.45095 1.257740   49.08757   301.6   15.57737 0.9923807          ?        ? 
1 1 1    1    6   18 o 135.8485 1.195372   148.4115   350.9   184.7332 3.247792          ?        ? 
1 1 1    1    6   19 o 58.63589 1.205227   64.96510    10.7   34.43261 1.413391          ?        ? 
1 1 1    1    6   20 o 26.05528 1.904375   23.52418    85.9   6.826377 0.9923807          ?        ? 
1 1 1    1    6   21 o 65.15524 1.084633   66.37132   172.4   42.58216 1.413391          ?        ? 
1 1 1    1    6   22 o 22.19190 2.642436   24.31162   126.3   5.052120 1.172814          ?        ? 
1 1 1    1    6   23 o 24.67939 3.533687   25.59494    27.6   6.555727 1.744184          ?        ? 
1 1 1    1    6   24 o 23.62417 3.500585   24.50263   328.7   6.164790 1.653968          ?        ? 
1 1 1    1    6   25 o 30.19159 2.838725   24.48867    89.4   10.04410 1.714112          ?        ? 
1 1 1    1    7    0 o 250.9262 2.427363   585.3815     0.0   629.8912 12.17922   629.8912 12.17922 
1 1 1    1    7    1 o 434.8399 2.683285   555.4601    16.0   1891.388 23.33598          ?        ? 
1 1 1    1    7    2 o 303.1247 1.934540   588.1155   338.0   918.9747 11.72814          ?        ? 
1 1 1    1    7    3 o 202.5273 1.499693   409.5721   314.4   410.2141 6.074574          ?        ? 
1 1 1    1    7    4 o 210.6279 1.763256   174.4444   303.4   443.7446 7.427820          ?        ? 
1 1 1    1    7    5 o 333.1305 2.911252   256.1900   250.1   1110.624 19.39653          ?        ? 
1 1 1    1    7    6 o 296.0836 2.564552   365.7148   255.1   877.0842 15.18643          ?        ? 
1 1 1    1    7    7 o 386.6491 3.274383   365.9644   223.9   1495.819 25.32075          ?        ? 
1 1 1    1    7    8 o 648.0033 5.172104   689.0822   282.5   4202.943 67.03081          ?        ? 
1 1 1    1    7    9 o 525.9748 4.322363   594.9023   301.5   2768.742 45.46908          ?        ? 
1 1 1    1    7   10 o 60.46915 1.118956   89.91745   319.0   36.56773 1.353247          ?        ? 
1 1 1    1    7   11 o 231.2031 1.892491   278.8232    95.7   534.7128 8.750995          ?        ? 
1 1 1    1    7   12 o 55.08106 1.010029   45.84524   319.2   30.34279 1.112669          ?        ? 
1 1 1    1    7   13 o 72.41289 0.9966893   44.62727    26.9   52.44582 1.443463          ?        ? 
1 1 1    1    7   14 o 45.97175 1.112045   54.46199   347.8   21.14072 1.022453          ?        ? 
1 1 1    1    7   15 o 83.95893 1.002895   96.95544    62.6   70.51918 1.684040          ?        ? 
1 1 1    1    7   16 o 138.9268 1.266293   166.9164   128.6   193.1534 3.518441          ?        ? 
1 1 1    1    7   17 o 100.5166 1.091992   100.2227    69.1   101.1026 2.195267          ?        ? 
1 1 1    1    7   18 o 21.48305 2.169703   21.23978    82.3   4.631110 0.9322364          ?        ? 
1 1 1    1    7   19 o 23.90289 2.201669   31.49741    14.6   5.743780 1.052525          ?        ? 
1 1 1    1    7   20 o 57.64564 1.069429   51.43790    90.2   33.28986 1.232958          ?        ? 
1 1 1    1    7   21 o 72.88163 1.175956   74.49641   125.4   53.31791 1.714112          ?        ? 
1 1 1    1    7   22 o 13.71599 3.950512   24.14729   118.2   2.044906 1.142741          ?        ? 
1 1 1    1    7   23 o 10.84040 4.117402   11.53266    71.7   1.052525 1.232958          ?        ? 
1 1 1    1    7   24 o 9.575323 4.132293   9.624202   126.4  0.2706493 1.443463          ?        ? 
1 1 1    1    7   25 o 11.79527 4.743650   17.54274    91.9   1.563751 1.714112          ?        ? 
1 1 1    1    8    0 o 211.6372 2.117661   263.7010   180.0   448.0750 8.961499   448.0750 8.961499 
1 1 1    1    8    1 o 507.4951 3.069462   758.0517   222.2   2576.431 31.15474          ?        ? 
1 1 1    1    8    2 o 133.9411 1.044007   363.9216   255.3   179.4104 2.796710          ?        ? 
1 1 1    1    8    3 o 159.4953 1.225547   252.0467    17.8   254.4103 3.909379          ?        ? 
1 1 1    1    8    4 o 120.3245 1.162153   116.5485   264.1   144.7974 2.796710          ?        ? 
1 1 1    1    8    5 o 116.3480 1.176026   345.7212    40.2   135.3848 2.736565          ?        ? 
1 1 1    1    8    6 o 89.65287 1.073372   114.7595   259.5   80.38284 1.924617          ?        ? 
1 1 1    1    8    7 o 102.3253 1.204940   143.6682   283.7   104.7112 2.465916          ?        ? 
1 1 1    1    8    8 o 254.1442 2.271880   269.8435   288.8   646.0098 11.54770          ?        ? 
1 1 1    1    8    9 o 71.22443 1.055542   177.7969    51.6   50.73171 1.503607          ?        ? 
1 1 1    1    8   10 o 120.6621 1.358282   168.5152   346.7   145.6093 3.277864          ?        ? 
1 1 1    1    8   11 o 173.4761 1.716169   210.1036   184.3   301.0222 5.954284          ?        ? 
1 1 1    1    8   12 o 323.2103 2.516787   355.4120   178.1   1045.488 16.26903          ?        ? 
1 1 1    1    8   13 o 41.50607 1.086786   83.42676    81.3   17.23134 0.9021643          ?        ? 
1 1 1    1    8   14 o 155.2509 1.346217   136.9917   230.3   241.1485 4.180028          ?        ? 
1 1 1    1    8   15 o 64.87214 0.9734765   76.25327   316.0   42.10100 1.263030          ?        ? 
1 1 1    1    8   16 o 82.81760 1.071183   93.48299   207.0   68.62463 1.774257          ?        ? 
1 1 1    1    8   17 o 54.73786 1.071300   83.49860   268.0   29.98193 1.172814          ?        ? 
1 1 1    1    8   18 o 78.99059 1.161152   86.60914   168.7   62.45984 1.834401          ?        ? 
1 1 1    1    8   19 o 110.0720 1.215759   118.5727    12.8   121.3712 2.676421          ?        ? 
1 1 1    1    8   20 o 40.86517 1.324597   64.01516    46.4   16.75019 1.082597          ?        ? 
1 1 1    1    8   21 o 20.24161 2.674188   14.20266    15.5   4.180028 1.082597          ?        ? 
1 1 1    1    8   22 f 20.87258 2.665385   27.58349   264.7   4.480750 1.112669          ?        ? 
1 1 1    1    8   23 o 13.48070 4.278074   7.355052   354.7   2.044906 1.293102          ?        ? 
1 1 1    1    8   24 o 23.31133 3.289558   23.31801   191.4   5.954284 1.533679          ?        ? 
1 1 1    1    9    0 o 158.9391 1.760095   492.8407     0.0   252.7263 5.593419   252.7263 5.593419 
1 1 1    1    9    1 o 349.3859 2.250768   186.0163   181.4   1220.989 15.72773          ?        ? 
1 1 1    1    9    2 o 197.0553 1.403991   484.2597   122.1   388.3517 5.533275          ?        ? 
1 1 1    1    9    3 o 406.7606 2.665206   464.9790    88.9   1655.502 21.68202          ?        ? 
1 1 1    1    9    4 o 273.7446 1.889502   449.2394   160.3   749.6083 10.34482          ?        ? 
1 1 1    1    9    5 o 167.8112 1.505299   160.2730   111.2   281.6557 5.052120          ?        ? 
1 1 1    1    9    6 o 242.2571 2.035784   162.3228   135.6   587.0383 9.863664          ?        ? 
1 1 1    1    9    7 o 207.4004 1.979190   237.1254   338.4   430.2121 8.209695          ?        ? 
1 1 1    1    9    8 o 304.1687 2.699060   309.6063   277.5   925.4401 16.41939          ?        ? 
1 1 1    1    9    9 o 232.8931 2.104725   327.0291   334.4   542.5015 9.803518          ?        ? 
1 1 1    1    9   10 o 167.9643 1.629254   142.7529   227.4   282.1669 5.473131          ?        ? 
1 1 1    1    9   11 o 266.7659 2.412392   328.8867   103.2   712.0483 12.87088          ?        ? 
1 1 1    1    9   12 o 286.2850 2.563041   348.7597   134.6   820.3681 14.67521          ?        ? 
1 1 1    1    9   13 o 193.2875 1.734745   183.8452   283.3   373.8268 6.706088          ?        ? 
1 1 1    1    9   14 f 31.25380 1.347069   9.163581   155.5   9.773447 0.8420200          ?        ? 
1 1 1    1    9   15 o 61.85895 1.020895   81.29930   111.9   38.28184 1.263030          ?        ? 
1 1 1    1    9   16 o 67.32268 1.049714   59.85477    90.4   45.34880 1.413391          ?        ? 
1 1 1    1    9   17 o 49.27426 1.129057   38.57863   130.0   24.29829 1.112669          ?        ? 
1 1 1    1    9   18 o 60.11473 1.150566   70.89609   334.4   36.17679 1.383319          ?        ? 
1 1 1    1    9   19 o 31.39392 1.772110   42.57239   335.2   9.893736 1.112669          ?        ? 
1 1 1    1    9   20 o 91.87722 1.194674   97.29189    73.4   84.65308 2.195267          ?        ? 
1 1 1    1    9   21 o 36.50048 1.524185   25.96683   224.9   13.41218 1.112669          ?        ? 
1 1 1    1    9   22 o 22.53962 2.334833   23.58842    18.1   5.202481 1.052525          ?        ? 
1 1 1    1    9   23 o 8.004267 3.536677   13.83955    77.8 -0.1804329 1.112669          ?        ? 
1 1 1    1    9   24 o 37.17917 1.981668   33.54969   124.6   14.31434 1.473535          ?        ? 
1 1 1    1   10    0 o 325.3513 3.101651   373.6920   180.0   1059.141 20.17841   1059.141 20.17841 
1 1 1    1   10    1 o 374.3303 2.414092   411.2805    33.9   1401.783 18.07336          ?        ? 
1 1 1    1   10    2 o 218.8372 1.532209   230.9707   200.2   478.9891 6.706088          ?        ? 
1 1 1    1   10    3 o 82.36446 0.7667324   106.5618   198.4   67.84276 1.263030          ?        ? 
1 1 1    1   10    4 o 31.21369 0.7225711   27.92008    31.2   9.743376 0.4510822          ?        ? 
1 1 1    1   10    5 o 119.8756 1.128875   123.1321    57.7   143.7148 2.706493          ?        ? 
1 1 1    1   10    6 o 165.6799 1.470211   300.7443   172.5   274.5286 4.871688          ?        ? 
1 1 1    1   10    7 o 407.3493 3.119063   465.0910   144.7   1659.892 25.41096          ?        ? 
1 1 1    1   10    8 o 550.7936 4.523432   556.4776   193.0   3036.324 49.82954          ?        ? 
1 1 1    1   10    9 o 180.6777 1.739306   186.8476   313.3   326.4933 6.285078          ?        ? 
1 1 1    1   10   10 o 281.5597 2.467209   358.1964    13.4   793.0927 13.89333          ?        ? 
1 1 1    1   10   11 o 152.1503 1.571299   116.4361    82.3   231.5555 4.781471          ?        ? 
1 1 1    1   10   12 o 128.6660 1.460766   133.2696   319.3   165.6073 3.759018          ?        ? 
1 1 1    1   10   13 o 123.0145 1.283416   127.5850   302.5   151.3832 3.157575          ?        ? 
1 1 1    1   10   14 o 50.22103 1.047893   66.83089     7.6   25.23053 1.052525          ?        ? 
1 1 1    1   10   15 o 164.2732 1.437035   178.8726     5.8   270.0779 4.721327          ?        ? 
1 1 1    1   10   16 o 40.12821 1.311453   61.97915   106.0   16.11867 1.052525          ?        ? 
1 1 1    1   10   17 o 44.90042 1.172066   45.36573    55.1   20.17841 1.052525          ?        ? 
1 1 1    1   10   18 o 66.40064 1.200157   50.41632    95.9   44.14591 1.593824          ?        ? 
1 1 1    1   10   19 o 39.50656 1.788805   43.34482    51.7   15.66759 1.413391          ?        ? 
1 1 1    1   10   20 o 11.96338 4.082785   15.61105    58.7   1.383319 1.172814          ?        ? 
1 1 1    1   10   21 o 61.95117 1.334896   64.48255   141.8   38.58256 1.653968          ?        ? 
1 1 1    1   10   22 o 17.39855 3.316714   23.25142   350.1   3.277864 1.112669          ?        ? 
1 1 1    1   10   23 o 39.01995 1.656976   42.42131    78.8   15.48715 1.293102          ?        ? 
1 1 1    1   10   24 o 22.36351 3.160038   27.10979    34.8   5.473131 1.413391          ?        ? 
1 1 1    1   11    0 o 172.8457 1.931748   42.17565   180.0   298.9171 6.676016   298.9171 6.676016 
1 1 1    1   11    1 o 288.3280 1.950380   229.5356   215.2   831.6151 11.24698          ?        ? 
1 1 1    1   11    2 o 470.2242 2.890666   513.5056   270.9   2212.829 27.18522          ?        ? 
1 1 1    1   11    3 o 295.2804 1.904458   381.9933   307.1   872.1824 11.24698          ?        ? 
1 1 1    1   11    4 o 86.96398 0.8472100   92.24998   308.1   75.63145 1.473535          ?        ? 
1 1 1    1   11    5 o 286.4946 2.130806   253.6050   357.3   821.0297 12.20929          ?        ? 
1 1 1    1   11    6 o 248.1509 1.896544   298.4724   277.4   615.8775 9.412581          ?        ? 
1 1 1    1   11    7 o 320.7303 2.573753   353.6776   204.0   1028.918 16.50961          ?        ? 
1 1 1    1   11    8 o 442.3050 3.355287   477.5839   150.3   1957.306 29.68121          ?        ? 
1 1 1    1   11    9 o 363.9800 3.222193   341.2227   344.4   1325.580 23.45627          ?        ? 
1 1 1    1   11   10 o 28.90964 1.872381   31.72346   193.7   8.360056 1.082597          ?        ? 
1 1 1    1   11   11 o 296.5010 2.642080   300.7921    24.3   879.7907 15.66759          ?        ? 
1 1 1    1   11   12 o 196.8586 2.001158   215.3478    22.3   387.8104 7.878902          ?        ? 
1 1 1    1   11   13 o 156.2604 1.626193   179.8914    68.4   244.3362 5.082192          ?        ? 
1 1 1    1   11   14 o 73.06636 1.111247   86.52368    89.8   53.40813 1.623896          ?        ? 
1 1 1    1   11   15 o 96.81041 1.025077   102.6542   304.0   93.76495 1.984761          ?        ? 
1 1 1    1   11   16 o 101.9674 1.105947   120.6655    71.0   104.0496 2.255411          ?        ? 
1 1 1    1   11   17 o 67.98381 1.039505   55.96246   299.7   46.25096 1.413391          ?        ? 
1 1 1    1   11   18 f 14.25117 3.415632   4.288718   130.1   2.135122 0.9623086          ?        ? 
1 1 1    1   11   19 o 65.83978 1.393079   77.88768   285.9   43.45425 1.834401          ?        ? 
1 1 1    1   11   20 o 36.74756 1.718522   36.44770    74.8   13.59261 1.263030          ?        ? 
1 1 1    1   11   21 o 21.80045 2.827827   32.26234    60.0   4.871688 1.232958          ?        ? 
1 1 1    1   11   22 o 22.31468 2.964807   16.25002   252.5   5.202481 1.323174          ?        ? 
1 1 1    1   11   23 o 26.53880 2.662877   27.42367   295.8   7.367675 1.413391          ?        ? 
1 1 1    1   11   24 o 13.19235 4.287044   12.73193   176.0   2.105050 1.293102          ?        ? 
1 1 1    1   12    0 o 252.7055 2.505519   183.6796    -0.0   638.9730 12.66037   638.9730 12.66037 
1 1 1    1   12    1 o 160.7117 1.263051   293.2068   258.0   258.3197 4.059740          ?        ? 
1 1 1    1   12    2 o 143.8624 1.128784   208.9491   295.8   206.9866 3.247792          ?        ? 
1 1 1    1   12    3 o 277.2195 1.827850   368.0535   343.1   768.7042 10.13431          ?        ? 
1 1 1    1   12    4 o 452.9722 2.907816   593.6716   345.8   2053.025 26.34320          ?        ? 
1 1 1    1   12    5 o 112.6757 1.014186   342.3617    10.8   126.9646 2.285483          ?        ? 
1 1 1    1   12    6 o 515.0279 3.567590   669.1111    45.2   2653.716 36.74816          ?        ? 
1 1 1    1   12    7 o 32.53436 1.155400   97.23763   188.9   10.58539 0.7518036          ?        ? 
1 1 1    1   12    8 o 360.0160 2.844198   434.1483   272.2   1296.591 20.47913          ?        ? 
1 1 1    1   12    9 o 84.50793 1.120928   78.46249   256.8   71.42134 1.894545          ?        ? 
1 1 1    1   12   10 o 359.8696 3.104403   367.4652   178.4   1296.230 22.34361          ?        ? 
1 1 1    1   12   11 o 56.21368 1.257159   52.05304   309.6   31.60582 1.413391          ?        ? 
1 1 1    1   12   12 o 233.8502 2.263285   214.2637   342.0   547.3732 10.58539          ?        ? 
1 1 1    1   12   13 o 28.05687 1.875699   28.64864   163.6   7.878902 1.052525          ?        ? 
1 1 1    1   12   14 o 166.2787 1.745240   149.2754   218.0   276.7840 5.803924          ?        ? 
1 1 1    1   12   15 o 123.4563 1.230106   127.9204   298.9   152.5259 3.037287          ?        ? 
1 1 1    1   12   16 o 113.5387 1.165395   128.2635   335.1   129.0095 2.646349          ?        ? 
1 1 1    1   12   17 o 85.41402 1.109036   99.38734   274.1   73.01517 1.894545          ?        ? 
1 1 1    1   12   18 o 48.89022 1.230190   44.30689   315.6   23.93743 1.202886          ?        ? 
1 1 1    1   12   19 o 70.09438 1.158364   73.42078   246.8   49.22810 1.623896          ?        ? 
1 1 1    1   12   20 o 48.17807 1.342003   54.86677     6.8   23.30591 1.293102          ?        ? 
1 1 1    1   12   21 o 25.22057 2.503968   29.06672   326.5   6.495584 1.263030          ?        ? 
1 1 1    1   12   22 o 23.37959 2.958390   18.94929   198.4   5.713707 1.383319          ?        ? 
1 1 1    1   12   23 o 31.26182 2.116279   33.13270   208.5   10.07417 1.323174          ?        ? 
1 1 1    1   12   24 o 23.33622 2.963888   17.94125    62.7   5.984357 1.383319          ?        ? 
1 1 1    1   13    0 o 46.98352 0.9609818   7.059251   180.0   22.10303 0.9021643   22.10303 0.9021643 
1 1 1    1   13    1 o 193.4074 1.461568   219.5424    52.4   374.1275 5.653563          ?        ? 
1 1 1    1   13    2 o 226.3809 1.587422   340.4887   121.5   512.5797 7.187243          ?        ? 
1 1 1    1   13    3 o 254.7968 1.729052   506.1467   303.7   649.3478 8.811138          ?        ? 
1 1 1    1   13    4 o 220.8963 1.477086   417.6421   296.5   488.0108 6.525656          ?        ? 
1 1 1    1   13    5 o 339.8469 2.300671   380.1965   332.2   1155.191 15.63752          ?        ? 
1 1 1    1   13    6 o 313.1527 2.333536   365.0808   141.2   980.8331 14.61506          ?        ? 
1 1 1    1   13    7 o 186.4961 1.556044   217.1503   171.8   347.8445 5.803924          ?        ? 
1 1 1    1   13    8 o 312.8932 2.484442   365.4691   171.0   979.3295 15.54730          ?        ? 
1 1 1    1   13    9 o 418.5319 3.233318   472.5745    60.8   1752.935 27.06493          ?        ? 
1 1 1    1   13   10 o 451.1981 3.472441   470.3438   290.7   2038.260 31.33517          ?        ? 
1 1 1    1   13   11 o 117.0465 1.413086   124.5493   222.7   137.0388 3.307936          ?        ? 
1 1 1    1   13   12 f 106.3599 1.300601   111.5170   176.7   113.1615 2.766637          ?        ? 
1 1 1    1   13   13 o 38.33613 1.451202   37.76622   236.3   14.70528 1.112669          ?        ? 
1 1 1    1   13   14 f 118.9277 1.365448   150.6691   161.1   141.5496 3.247792          ?        ? 
1 1 1    1   13   15 o 64.95572 1.203706   64.87612    33.6   42.22129 1.563751          ?        ? 
1 1 1    1   13   16 o 81.23452 1.147587   84.36155   266.9   66.03843 1.864473          ?        ? 
1 1 1    1   13   17 o 95.14811 1.090394   87.05719   291.6   90.60737 2.074978          ?        ? 
1 1 1    1   13   18 o 29.88704 1.811149   31.66364   111.1   8.961499 1.082597          ?        ? 
1 1 1    1   13   19 o 15.90679 3.497713   21.13053   150.5   2.676421 1.082597          ?        ? 
1 1 1    1   13   20 o 70.42608 1.088858   73.51613   254.8   49.73933 1.533679          ?        ? 
1 1 1    1   13   21 o 42.11683 1.392334   35.93558    82.3   17.86285 1.172814          ?        ? 
1 1 1    1   13   22 o 20.87793 3.024798   15.90507    47.8   4.570966 1.263030          ?        ? 
1 1 1    1   13   23 o 10.69898 4.278553   4.990824   154.2  0.9021643 1.383319          ?        ? 
1 1 1    1   13   24 o 9.601681 4.137842   13.05310   354.2  0.4510822 1.443463          ?        ? 
1 1 1    1   14    0 o 14.87331 1.867627   7.937750   180.0   2.315555 0.5412986   2.315555 0.5412986 
1 1 1    1   14    1 o 416.6852 2.648637   572.1716   182.2   1737.117 22.07295          ?        ? 
1 1 1    1   14    2 o 204.9212 1.482173   183.0752   149.3   419.9876 6.074574          ?        ? 
1 1 1    1   14    3 o 156.1044 1.184744   163.7586   191.9   243.7047 3.698874          ?        ? 
1 1 1    1   14    4 o 312.9124 1.998964   411.2087   307.7   979.2994 12.51001          ?        ? 
1 1 1    1   14    5 o 289.2795 2.219446   335.0127    96.9   836.9679 12.84081          ?        ? 
1 1 1    1   14    6 o 318.7384 2.368120   330.7021   163.8   1016.168 15.09622          ?        ? 
1 1 1    1   14    7 o 452.3606 3.164365   503.5967    30.5   2047.221 28.62868          ?        ? 
1 1 1    1   14    8 o 137.2968 1.281326   223.5541    15.0   188.5223 3.518441          ?        ? 
1 1 1    1   14    9 o 338.4974 2.696297   330.0319   163.8   1146.500 18.25379          ?        ? 
1 1 1    1   14   10 o 350.2050 3.713883   346.2452   135.4   1228.237 26.01241          ?        ? 
1 1 1    1   14   11 o 122.7397 1.261788   120.5598    13.6   150.6915 3.097431          ?        ? 
1 1 1    1   14   12 o 83.86841 1.344613   104.3708   163.7   70.36882 2.255411          ?        ? 
1 1 1    1   14   13 o 8.111910 3.432799   43.40062    75.6       0.03 0.9623086          ?        ? 
1 1 1    1   14   14 o 185.9900 1.956411   213.0541     8.4   346.4612 7.277459          ?        ? 
1 1 1    1   14   15 o 44.22430 1.393983   50.42815   254.5   19.57697 1.232958          ?        ? 
1 1 1    1   14   16 o 147.6434 1.476687   154.9218    35.4   218.2636 4.360461          ?        ? 
1 1 1    1   14   17 o 50.61705 1.247633   69.04060   107.2   25.65154 1.263030          ?        ? 
1 1 1    1   14   18 o 83.42939 1.135418   105.4400    56.7   69.70723 1.894545          ?        ? 
1 1 1    1   14   19 o 13.99784 3.540462   17.42022   103.1   2.074978 0.9923807          ?        ? 
1 1 1    1   14   20 o 40.55050 1.483195   41.74963   310.8   16.53968 1.202886          ?        ? 
1 1 1    1   14   21 o 50.26284 1.256425   52.22482   326.9   25.41096 1.263030          ?        ? 
1 1 1    1   14   22 o 13.23417 3.925495   10.39588    62.1   1.954689 1.112669          ?        ? 
1 1 1    1   14   23 o 10.43745 3.964035   7.854732   100.4   1.022453 1.142741          ?        ? 
1 1 1    1   14   24 o 8.578683 3.835975   8.479498   319.1      -0.06 1.353247          ?        ? 
1 1 1    1   15    0 o 284.9249 2.718316   371.3128   180.0   812.2185 15.48715   812.2185 15.48715 
1 1 1    1   15    1 o 70.20435 0.7924504   114.0776   359.6   49.28824 1.112669          ?        ? 
1 1 1    1   15    2 o 84.58103 0.7821934   164.1985    23.3   71.54163 1.323174          ?        ? 
1 1 1    1   15    3 o 478.9637 2.925821   633.4376   222.9   2294.835 28.02724          ?        ? 
1 1 1    1   15    4 o 181.5821 1.341456   120.6648    60.2   329.7411 4.871688          ?        ? 
1 1 1    1   15    5 o 767.5732 4.726851   751.5051    87.2   5896.576 72.56409          ?        ? 
1 1 1    1   15    6 o 156.4882 1.431658   137.0082   312.7   244.9075 4.480750          ?        ? 
1 1 1    1   15    7 o 316.0202 2.345668   362.6347   330.4   998.9666 14.82557          ?        ? 
1 1 1    1   15    8 o 443.4241 3.092502   554.2534    73.2   1967.470 27.42579          ?        ? 
1 1 1    1   15    9 o 125.2819 1.176175   195.1225    38.6   156.9766 2.947070          ?        ? 
1 1 1    1   15   10 o 190.1087 1.605567   211.6760   130.2   361.5273 6.104645          ?        ? 
1 1 1    1   15   11 o 111.0083 1.286775   75.35506   232.6   123.2657 2.856854          ?        ? 
1 1 1    1   15   12 o 208.3579 1.789683   229.1240   254.9   434.4824 7.457891          ?        ? 
1 1 1    1   15   13 o 64.93902 1.227170   65.27093    43.7   42.19122 1.593824          ?        ? 
1 1 1    1   15   14 o 175.8227 1.881405   184.4606   283.2   309.5927 6.615872          ?        ? 
1 1 1    1   15   15 o 69.54808 1.275561   73.88778   292.1   48.41615 1.774257          ?        ? 
1 1 1    1   15   16 o 102.8928 1.402881   131.0256    45.1   106.0043 2.886926          ?        ? 
1 1 1    1   15   17 o 84.17001 1.250475   77.16397    38.7   70.94019 2.105050          ?        ? 
1 1 1    1   15   18 o 72.53194 1.098705   78.50546   284.7   52.68640 1.593824          ?        ? 
1 1 1    1   15   19 o 21.68805 2.287852   16.48475   191.9   4.751399 0.9923807          ?        ? 
1 1 1    1   15   20 o 16.13828 3.543695   27.18373   354.4   2.796710 1.112669          ?        ? 
1 1 1    1   15   21 o 22.75047 2.379285   26.01974   248.1   5.292697 1.082597          ?        ? 
1 1 1    1   15   22 o 28.18568 2.027167   30.68528    58.1   8.149551 1.142741          ?        ? 
1 1 1    1   15   23 o 25.92403 2.436022   22.85447   107.2   7.066954 1.263030          ?        ? 
1 1 1    1   15   24 o 13.39598 4.103661   13.79029   293.4   2.255411 1.202886          ?        ? 
1 1 1    1   16    0 o 12.82822 2.815339   15.05458     0.0   1.864473 0.6315150   1.864473 0.6315150 
1 1 1    1   16    1 o 390.8280 2.523786   572.3262   282.7   1527.845 19.72733          ?        ? 
1 1 1    1   16    2 o 201.6592 1.461411   208.6688    48.2   406.6957 5.894140          ?        ? 
1 1 1    1   16    3 o 189.7604 1.386650   186.5594    96.0   360.1139 5.262625          ?        ? 
1 1 1    1   16    4 o 398.6028 2.455698   375.8081   218.3   1589.193 19.57697          ?        ? 
1 1 1    1   16    5 o 281.5024 1.837430   286.0117     3.1   792.5514 10.34482          ?        ? 
1 1 1    1   16    6 o 129.8130 1.135121   157.7092   254.1   168.5243 2.947070          ?        ? 
1 1 1    1   16    7 o 168.9579 1.486183   194.9473    57.6   285.5049 5.022048          ?        ? 
1 1 1    1   16    8 o 228.2103 1.825068   245.4368    95.4   520.9398 8.329985          ?        ? 
1 1 1    1   16    9 o 110.5693 1.183094   146.9924   243.9   122.2733 2.616277          ?        ? 
1 1 1    1   16   10 o 115.4083 1.185602   102.8116    79.5   133.2196 2.736565          ?        ? 
1 1 1    1   16   11 o 32.38887 1.531978   51.24416   235.9   10.49518 0.9923807          ?        ? 
1 1 1    1   16   12 o 81.41463 1.200453   68.73367   314.8   66.30908 1.954689          ?        ? 
1 1 1    1   16   13 o 90.29987 1.198891   119.5557   289.1   81.58572 2.165194          ?        ? 
1 1 1    1   16   14 o 40.57446 1.445261   39.92306   206.8   16.47953 1.172814          ?        ? 
1 1 1    1   16   15 o 96.18829 1.375609   130.0216    31.7   92.62221 2.646349          ?        ? 
1 1 1    1   16   16 o 22.61862 2.792014   34.19270   295.7   5.142337 1.263030          ?        ? 
1 1 1    1   16   17 o 24.02396 2.440925   33.41798    23.0   5.803924 1.172814          ?        ? 
1 1 1    1   16   18 o 39.21778 1.571938   51.41571    16.7   15.42701 1.232958          ?        ? 
1 1 1    1   16   19 o 17.14729 3.188248   19.16653    67.8   3.097431 1.052525          ?        ? 
1 1 1    1   16   20 o 12.22544 3.791206   5.435273   329.3   1.563751 1.022453          ?        ? 
1 1 1    1   16   21 o 28.69856 1.990939   35.13371    80.3   8.390128 1.142741          ?        ? 
1 1 1    1   16   22 o 23.70894 2.473357   26.86782    19.2   5.833996 1.172814          ?        ? 
1 1 1    1   16   23 o 10.91005 4.086267   10.74327   112.2   1.202886 1.202886          ?        ? 
1 1 1    1   17    0 o 79.62748 1.228050   178.1045     0.0   63.45222 1.954689   63.45222 1.954689 
1 1 1    1   17    1 o 369.5852 2.420676   449.6089   126.1   1366.208 17.89293          ?        ? 
1 1 1    1   17    2 o 237.8242 1.643810   346.0536   296.8   565.6570 7.818758          ?        ? 
1 1 1    1   17    3 o 307.1432 2.007138   388.0962   101.1   943.5135 12.32958          ?        ? 
1 1 1    1   17    4 o 185.4642 1.313377   227.3936   155.0   343.9953 4.871688          ?        ? 
1 1 1    1   17    5 o 166.9664 1.296785   210.5489    49.6   278.7989 4.330389          ?        ? 
1 1 1    1   17    6 o 75.84525 0.9714090   64.81540   191.3   57.52802 1.473535          ?        ? 
1 1 1    1   17    7 o 288.4651 2.210075   281.7918   355.0   832.3970 12.75059          ?        ? 
1 1 1    1   17    8 o 154.4590 1.421262   156.3710   294.6   238.6225 4.390533          ?        ? 
1 1 1    1   17    9 o 272.3106 2.092710   315.6119   295.8   741.9099 11.39734          ?        ? 
1 1 1    1   17   10 o 152.1829 1.383237   152.0162   355.3   231.6758 4.210100          ?        ? 
1 1 1    1   17   11 o 133.3216 1.274419   135.6234   212.1   177.8166 3.398152          ?        ? 
1 1 1    1   17   12 o 37.22335 1.292614   37.60920   235.9   13.86326 0.9623086          ?        ? 
1 1 1    1   17   13 o 84.19922 1.232184   67.30621   216.3   70.94019 2.074978          ?        ? 
1 1 1    1   17   14 o 34.96399 1.591165   20.63092    53.7   12.23936 1.112669          ?        ? 
1 1 1    1   17   15 o 72.63826 1.221296   79.97645   320.7   52.80669 1.774257          ?        ? 
1 1 1    1   17   16 o 38.74557 1.513481   14.00514   277.0   15.03607 1.172814          ?        ? 
1 1 1    1   17   17 o 54.36849 1.465760   64.41386    15.3   29.62106 1.593824          ?        ? 
1 1 1    1   17   18 o 28.50989 2.056854   30.58002   144.7   8.179624 1.172814          ?        ? 
1 1 1    1   17   19 o 49.74890 1.269405   57.52937   177.0   24.83959 1.263030          ?        ? 
1 1 1    1   17   20 o 22.37283 2.553860   26.38308   205.8   5.112265 1.142741          ?        ? 
1 1 1    1   17   21 o 31.76020 1.799015   27.16677   272.3   10.25460 1.142741          ?        ? 
1 1 1    1   17   22 o 14.95472 3.728773   21.57318   317.1   2.526060 1.112669          ?        ? 
1 1 1    1   17   23 o 8.805643 3.734309   8.799088    99.1  0.3307936 1.142741          ?        ? 
1 1 1    1   18    0 o 200.5160 2.175194   215.8442   180.0   402.2450 8.720922   402.2450 8.720922 
1 1 1    1   18    1 o 282.0991 1.972125   265.6799    10.5   795.9194 11.12669          ?        ? 
1 1 1    1   18    2 o 214.2095 1.523195   255.7974   173.8   458.9009 6.525656          ?        ? 
1 1 1    1   18    3 o 202.4758 1.477796   232.9525    93.3   410.0036 5.984357          ?        ? 
1 1 1    1   18    4 o 361.2473 2.310057   408.1084    47.9   1305.312 16.69004          ?        ? 
1 1 1    1   18    5 o 292.3302 1.939109   333.8491   179.0   854.7406 11.33720          ?        ? 
1 1 1    1   18    6 o 201.1367 1.547439   284.1681   125.6   404.6207 6.224934          ?        ? 
1 1 1    1   18    7 o 299.0093 2.257855   315.4476   313.0   894.4658 13.50239          ?        ? 
1 1 1    1   18    8 o 56.21518 1.150136   86.26612   331.6   31.60582 1.293102          ?        ? 
1 1 1    1   18    9 o 48.01984 1.346425   56.33280   237.4   23.06533 1.293102          ?        ? 
1 1 1    1   18   10 o 175.2203 1.536042   215.6182    58.9   307.1569 5.382914          ?        ? 
1 1 1    1   18   11 o 7.995609 3.350704   9.831773   172.4       0.09 0.9021643          ?        ? 
1 1 1    1   18   12 o 114.0061 1.173806   129.0889   329.9   130.0320 2.676421          ?        ? 
1 1 1    1   18   13 o 108.2253 1.153145   122.7607   354.7   117.1912 2.495988          ?        ? 
1 1 1    1   18   14 o 21.69832 2.217473   42.18311   190.2   4.721327 0.9623086          ?        ? 
1 1 1    1   18   15 o 79.41229 1.230722   79.84644   231.5   63.12143 1.954689          ?        ? 
1 1 1    1   18   16 f 79.30886 1.213368   77.27080   195.3   62.97107 1.924617          ?        ? 
1 1 1    1   18   17 o 50.32636 1.374348   44.48177    64.7   25.38089 1.383319          ?        ? 
1 1 1    1   18   18 o 55.20887 1.252805   67.88830   125.4   30.55330 1.383319          ?        ? 
1 1 1    1   18   19 o 29.77091 1.767707   24.30550   246.9   8.931427 1.052525          ?        ? 
1 1 1    1   18   20 o 35.86967 1.425233   31.40549   192.6   12.96109 1.022453          ?        ? 
1 1 1    1   18   21 o 64.36169 1.261539   57.94214   202.2   41.77021 1.623896          ?        ? 
1 1 1    1   18   22 f 12.94302 4.128047   8.639629   281.6   1.894545 1.202886          ?        ? 
1 1 1    1   18   23 o 8.320154 3.657484   4.843662   293.8       0.06 1.172814          ?        ? 
1 1 1    1   19    0 o 132.1835 1.581654   173.4447   180.0   174.8094 4.180028   174.8094 4.180028 
1 1 1    1   19    1 o 466.7627 2.892775   450.8673   239.6   2179.479 27.00479          ?        ? 
1 1 1    1   19    2 o 119.3376 1.058367   176.7571   258.3   142.4217 2.526060          ?        ? 
1 1 1    1   19    3 o 691.1353 4.066124   686.5549   232.0   4780.389 56.20484          ?        ? 
1 1 1    1   19    4 o 554.6494 3.361534   539.6560   239.7   3078.245 37.28946          ?        ? 
1 1 1    1   19    5 o 96.50297 0.9504375   128.7187   320.1   93.13344 1.834401          ?        ? 
1 1 1    1   19    6 o 52.96680 1.050346   66.87691   162.4   28.05731 1.112669          ?        ? 
1 1 1    1   19    7 o 292.2031 2.248698   293.6213   252.3   854.2594 13.14153          ?        ? 
1 1 1    1   19    8 o 116.2410 1.215914   116.0202   292.4   135.1442 2.826782          ?        ? 
1 1 1    1   19    9 o 199.0944 1.699253   209.0486   349.1   396.5915 6.766232          ?        ? 
1 1 1    1   19   10 o 114.2891 1.197212   149.9335   224.9   130.6635 2.736565          ?        ? 
1 1 1    1   19   11 o 110.7441 1.181226   106.7253   194.6   122.6944 2.616277          ?        ? 
1 1 1    1   19   12 o 47.97940 1.253544   24.77247   120.4   23.03526 1.202886          ?        ? 
1 1 1    1   19   13 o 121.4909 1.262383   122.6570   314.8   147.7144 3.067359          ?        ? 
1 1 1    1   19   14 o 42.45626 1.310372   62.66047   112.8   18.04329 1.112669          ?        ? 
1 1 1    1   19   15 o 94.18169 1.101583   84.36769    68.8   88.77297 2.074978          ?        ? 
1 1 1    1   19   16 o 99.00569 1.093470   85.75758   316.2   98.12540 2.165194          ?        ? 
1 1 1    1   19   17 o 18.08960 2.992319   17.14824    56.9   3.307936 1.082597          ?        ? 
1 1 1    1   19   18 o 49.95201 1.444850   42.73686    80.6   25.05010 1.443463          ?        ? 
1 1 1    1   19   19 o 25.56117 2.117660   32.33072   100.0   6.615872 1.082597          ?        ? 
1 1 1    1   19   20 o 52.73584 1.226019   59.49454    72.5   27.96709 1.293102          ?        ? 
1 1 1    1   19   21 o 52.09089 1.270063   45.67006    78.8   27.39572 1.323174          ?        ? 
1 1 1    1   19   22 o 21.82461 2.273536   14.14048   167.2   4.961904 0.9923807          ?        ? 
1 1 1    1   19   23 o 7.040119 3.255580   1.715400   196.0 -0.5713707 1.082597          ?        ? 
1 1 1    1   20    0 f 393.7313 3.613332   284.8600     0.0   1551.121 28.44825   1551.121 28.44825 
1 1 1    1   20    1 o 112.3685 1.003578   133.7361    37.9   126.2729 2.255411          ?        ? 
1 1 1    1   20    2 o 206.4301 1.478623   176.4745    84.4   426.1824 6.104645          ?        ? 
1 1 1    1   20    3 o 374.0395 2.343611   353.8792    17.9   1399.497 17.53206          ?        ? 
1 1 1    1   20    4 o 308.7234 2.021217   308.5881   235.4   953.3471 12.47994          ?        ? 
1 1 1    1   20    5 o 249.6247 1.746807   255.5803   264.1   623.2753 8.720922          ?        ? 
1 1 1    1   20    6 o 30.52906 1.526802   11.90097   202.5   9.322365 0.9322364          ?        ? 
1 1 1    1   20    7 f 78.96998 1.009133   36.51492   269.2   62.36963 1.593824          ?        ? 
1 1 1    1   20    8 o 246.7715 1.986356   224.2161   192.7   609.3519 9.803518          ?        ? 
1 1 1    1   20    9 o 217.5818 1.762187   191.9937   134.9   473.6964 7.668397          ?        ? 
1 1 1    1   20   10 o 108.9687 1.200472   94.36772    76.1   118.7850 2.616277          ?        ? 
1 1 1    1   20   11 o 224.2210 1.770362   237.8042     7.2   503.2574 7.939046          ?        ? 
1 1 1    1   20   12 o 70.89032 1.145358   63.12003    46.2   50.28062 1.623896          ?        ? 
1 1 1    1   20   13 o 82.19741 1.079265   101.4068    80.3   67.60218 1.774257          ?        ? 
1 1 1    1   20   14 o 116.3938 1.265992   152.3515    32.0   135.5953 2.947070          ?        ? 
1 1 1    1   20   15 o 48.30750 1.369533   56.25543    57.6   23.36606 1.323174          ?        ? 
1 1 1    1   20   16 o 58.42918 1.260958   74.84556   137.6   34.19203 1.473535          ?        ? 
1 1 1    1   20   17 o 50.27015 1.226332   53.84681   113.8   25.32075 1.232958          ?        ? 
1 1 1    1   20   18 o 32.34776 1.626890   42.28675   187.1   10.52525 1.052525          ?        ? 
1 1 1    1   20   19 f 21.95398 2.397117   18.92224    37.4   4.901759 1.052525          ?        ? 
1 1 1    1   20   20 o 38.56815 1.403486   34.35672   258.8   15.00600 1.082597          ?        ? 
1 1 1    1   20   21 o 6.781502 3.164298   6.823473   231.2 -0.8420200 1.052525          ?        ? 
1 1 1    1   20   22 o 14.01071 3.538512   14.64319   252.3   2.255411 0.9923807          ?        ? 
1 1 1    1   20   23 o 15.10563 3.705906   10.93094   349.7   2.766637 1.112669          ?        ? 
1 1 1    1   21    0 o 179.1537 1.947654   212.4933   180.0   321.1104 6.976738   321.1104 6.976738 
1 1 1    1   21    1 o 132.8458 1.120525   120.4570   101.5   176.4934 2.977142          ?        ? 
1 1 1    1   21    2 o 193.3027 1.423467   228.9343    20.8   373.7065 5.503202          ?        ? 
1 1 1    1   21    3 o 210.2211 1.537789   160.9188   114.3   442.0004 6.465511          ?        ? 
1 1 1    1   21    4 o 254.1290 1.745429   307.9549    60.0   645.9798 8.871283          ?        ? 
1 1 1    1   21    5 o 120.3003 1.049898   172.7152   281.6   144.7372 2.526060          ?        ? 
1 1 1    1   21    6 o 384.3455 2.445078   397.7138   318.2   1478.166 18.79509          ?        ? 
1 1 1    1   21    7 o 61.15873 1.032584   55.27083    33.6   37.40975 1.263030          ?        ? 
1 1 1    1   21    8 o 59.18249 1.143283   43.31632    30.8   35.03405 1.353247          ?        ? 
1 1 1    1   21    9 o 84.92417 1.115433   97.93981   305.5   72.14307 1.894545          ?        ? 
1 1 1    1   21   10 o 108.6756 1.176038   129.8339   186.1   118.1535 2.556132          ?        ? 
1 1 1    1   21   11 o 76.47956 1.120634   81.09937    23.3   58.52040 1.714112          ?        ? 
1 1 1    1   21   12 o 63.27055 1.140707   58.71973   317.3   40.05610 1.443463          ?        ? 
1 1 1    1   21   13 o 38.71362 1.437052   41.12802   199.2   15.00600 1.112669          ?        ? 
1 1 1    1   21   14 o 109.4910 1.181013   100.7523   298.4   119.9879 2.586205          ?        ? 
1 1 1    1   21   15 o 92.59433 1.152944   98.33599   103.2   85.82590 2.135122          ?        ? 
1 1 1    1   21   16 o 134.1022 1.244576   131.4531    49.9   180.1321 3.338008          ?        ? 
1 1 1    1   21   17 o 30.15686 1.844803   15.06479   230.7   9.141932 1.112669          ?        ? 
1 1 1    1   21   18 o 39.21966 1.456848   40.74725   302.2   15.45708 1.142741          ?        ? 
1 1 1    1   21   19 o 24.59212 2.078822   29.97897   245.1   6.134717 1.022453          ?        ? 
1 1 1    1   21   20 o 12.14372 3.796315   9.042034   234.7   1.593824 1.022453          ?        ? 
1 1 1    1   21   21 o 23.05825 2.151900   17.09466   125.3   5.473131 0.9923807          ?        ? 
1 1 1    1   21   22 o 9.746610 3.607825   7.087020   216.6  0.9322364 0.9322364          ?        ? 
1 1 1    1   22    0 o 589.4707 5.046264   554.7056     0.0   3478.746 59.48270   3478.746 59.48270 
1 1 1    1   22    1 o 335.7145 2.234935   364.2689    82.8   1127.465 15.00600          ?        ? 
1 1 1    1   22    2 o 164.3566 1.299080   179.3083   286.4   270.1682 4.270245          ?        ? 
1 1 1    1   22    3 o 79.29416 0.9481198   60.91285   125.4   62.88086 1.503607          ?        ? 
1 1 1    1   22    4 o 246.1202 1.686150   202.9872   350.8   605.9236 8.299912          ?        ? 
1 1 1    1   22    5 o 209.5602 1.513938   211.7692   332.3   439.2638 6.345222          ?        ? 
1 1 1    1   22    6 o 159.5881 1.271943   153.9401   225.6   254.7411 4.059740          ?        ? 
1 1 1    1   22    7 o 150.9039 1.365069   136.7290   177.2   227.7965 4.119884          ?        ? 
1 1 1    1   22    8 o 65.66040 1.076289   64.95559   190.3   43.12346 1.413391          ?        ? 
1 1 1    1   22    9 o 78.48455 1.111164   101.1005   174.4   61.61782 1.744184          ?        ? 
1 1 1    1   22   10 o 92.83382 1.133773   132.0508    40.3   86.21684 2.105050          ?        ? 
1 1 1    1   22   11 o 13.47707 3.903554   22.36441    72.6   1.864473 1.112669          ?        ? 
1 1 1    1   22   12 o 61.44030 1.101269   72.86298   195.1   37.77061 1.353247          ?        ? 
1 1 1    1   22   13 o 79.72199 1.150499   65.00632   148.3   63.60258 1.834401          ?        ? 
1 1 1    1   22   14 o 100.5529 1.121505   96.12521   214.6   101.1928 2.255411          ?        ? 
1 1 1    1   22   15 f 30.03678 1.902237   35.00448   235.9   9.051716 1.142741          ?        ? 
1 1 1    1   22   16 o 79.79144 1.224874   97.69810   292.1   63.78302 1.954689          ?        ? 
1 1 1    1   22   17 o 85.15588 1.253655   78.82505   159.3   72.71445 2.135122          ?        ? 
1 1 1    1   22   18 o 21.63669 2.362776   12.70907   250.2   4.751399 1.022453          ?        ? 
1 1 1    1   22   19 o 21.89547 2.472194   11.10678    41.1   4.901759 1.082597          ?        ? 
1 1 1    1   22   20 f 74.24706 1.194833   64.98896     1.9   55.54325 1.774257          ?        ? 
1 1 1    1   22   21 o 16.28759 3.159177   19.29276   106.4   2.916998 0.9923807          ?        ? 
1 1 1    1   22   22 o 7.013709 3.194618   2.825144    86.1 -0.3909379 0.9923807          ?        ? 
1 1 1    1   23    0 o 537.9778 4.673905   515.2708     0.0   2897.902 50.28062   2897.902 50.28062 
1 1 1    1   23    1 o 76.82874 0.9394031   117.9358    84.6   59.03162 1.443463          ?        ? 
1 1 1    1   23    2 o 54.33974 0.9684671   51.55538   166.5   29.53085 1.052525          ?        ? 
1 1 1    1   23    3 o 108.4846 1.039507   119.2459   203.4   117.7024 2.255411          ?        ? 
1 1 1    1   23    4 o 180.4809 1.357972   140.2524   307.9   325.8016 4.901759          ?        ? 
1 1 1    1   23    5 o 34.85170 1.251147   35.26233   263.5   12.14915 0.8720922          ?        ? 
1 1 1    1   23    6 o 80.83083 0.9486970   73.46081    92.8   65.34677 1.533679          ?        ? 
1 1 1    1   23    7 o 198.3189 1.569425   188.6663    27.6   393.4940 6.224934          ?        ? 
1 1 1    1   23    8 o 135.3758 1.343937   186.1636   327.1   183.3499 3.638730          ?        ? 
1 1 1    1   23    9 o 99.88234 1.174195   151.1852    10.5   99.80945 2.345627          ?        ? 
1 1 1    1   23   10 o 51.01463 1.267384   48.81797   335.0   26.04248 1.293102          ?        ? 
1 1 1    1   23   11 o 71.09866 1.142002   101.5655   194.0   50.58134 1.623896          ?        ? 
1 1 1    1   23   12 o 21.96419 2.464460   19.99827   178.3   4.841615 1.082597          ?        ? 
1 1 1    1   23   13 o 101.9002 1.224722   87.02477   118.0   103.9293 2.495988          ?        ? 
1 1 1    1   23   14 o 138.1848 1.338379   136.7706    94.4   191.1987 3.698874          ?        ? 
1 1 1    1   23   15 o 65.98708 1.207679   57.55848   162.0   43.60461 1.593824          ?        ? 
1 1 1    1   23   16 o 14.05134 3.919852   24.38455    99.3   2.074978 1.142741          ?        ? 
1 1 1    1   23   17 o 23.11800 2.406500   18.93262    81.0   5.412986 1.112669          ?        ? 
1 1 1    1   23   18 o 21.23903 2.619398   28.13762   195.9   4.601038 1.112669          ?        ? 
1 1 1    1   23   19 o 13.20368 3.787592   14.27421   208.1   1.894545 1.052525          ?        ? 
1 1 1    1   23   20 o 6.553201 3.117707   8.704218   262.4  -1.232958 1.112669          ?        ? 
1 1 1    1   23   21 o 38.25304 1.532968   22.28552   277.0   14.91578 1.172814          ?        ? 
1 1 1    1   23   22 o 24.90884 2.173119   28.75895   148.0   6.555727 1.082597          ?        ? 
1 1 1    1   24    0 o 377.7868 3.475237   320.0999   180.0   1428.517 26.25298   1428.517 26.25298 
1 1 1    1   24    1 o 73.61076 0.8783377   41.48077   130.8   54.19000 1.293102          ?        ? 
1 1 1    1   24    2 o 117.5178 1.036372   83.41188   310.1   138.1214 2.435844          ?        ? 
1 1 1    1   24    3 o 85.68935 1.000190   111.4631   167.6   73.43618 1.714112          ?        ? 
1 1 1    1   24    4 o 100.9602 0.9680500   91.36333   301.7   101.9446 1.954689          ?        ? 
1 1 1    1   24    5 o 47.48618 1.076579   85.23200   151.9   22.55411 1.022453          ?        ? 
1 1 1    1   24    6 o 95.39996 0.9771875   73.84612   337.6   91.02839 1.864473          ?        ? 
1 1 1    1   24    7 o 39.83852 1.320989   83.07181   231.6   15.87809 1.052525          ?        ? 
1 1 1    1   24    8 o 67.39366 1.204784   73.71137    97.3   45.43901 1.623896          ?        ? 
1 1 1    1   24    9 o 34.70951 1.646150   34.74119    11.1   12.05893 1.142741          ?        ? 
1 1 1    1   24   10 o 158.9992 1.475245   172.6458   158.3   253.0270 4.691255          ?        ? 
1 1 1    1   24   11 o 39.67225 1.591831   39.14768   175.4   15.75780 1.263030          ?        ? 
1 1 1    1   24   12 o 53.25554 1.298756   49.66575   253.4   28.38811 1.383319          ?        ? 
1 1 1    1   24   13 o 175.9719 1.520936   169.1442     7.7   310.1340 5.352841          ?        ? 
1 1 1    1   24   14 o 92.09524 1.224499   98.83974   316.5   84.92374 2.255411          ?        ? 
1 1 1    1   24   15 o 118.7055 1.292003   119.3015   347.1   141.1887 3.067359          ?        ? 
1 1 1    1   24   16 o 61.46376 1.198702   62.76810    44.4   37.86083 1.473535          ?        ? 
1 1 1    1   24   17 f 33.75645 1.870798   30.36721   223.2   11.48756 1.263030          ?        ? 
1 1 1    1   24   18 o 32.17511 1.822548   30.87717    30.1   10.46511 1.172814          ?        ? 
1 1 1    1   24   19 o 32.73164 1.791560   38.69491   175.1   10.88612 1.172814          ?        ? 
1 1 1    1   24   20 o 19.15102 2.826474   26.44716   206.0   3.849235 1.082597          ?        ? 
1 1 1    1   24   21 o 18.40820 3.394671   21.17042    86.5   3.819162 1.202886          ?        ? 
1 1 1    1   24   22 o 7.525940 3.395398   13.19486   263.7 -0.2105050 1.082597          ?        ? 
1 1 1    1   25    0 o 149.8330 1.736617   110.5440     0.0   224.6389 5.202481   224.6389 5.202481 
1 1 1    1   25    1 o 180.2723 1.426270   178.7967   123.0   325.0799 5.142337          ?        ? 
1 1 1    1   25    2 o 332.6648 2.205705   320.4654    49.4   1107.527 14.67521          ?        ? 
1 1 1    1   25    3 o 229.4888 1.618341   179.2436    43.4   526.8940 7.427820          ?        ? 
1 1 1    1   25    4 o 43.90018 1.061768   61.00858   185.2   19.27625 0.9322364          ?        ? 
1 1 1    1   25    5 o 135.4887 1.143059   121.2003    71.9   183.6205 3.097431          ?        ? 
1 1 1    1   25    6 o 69.27089 0.9333663   82.71156   274.7   47.99514 1.293102          ?        ? 
1 1 1    1   25    7 o 193.0807 1.596428   208.1432   229.9   373.0750 6.164790          ?        ? 
1 1 1    1   25    8 o 100.3018 1.199266   147.8626   264.3   100.6515 2.405771          ?        ? 
1 1 1    1   25    9 o 36.27107 1.699644   15.25884   208.6   13.17160 1.232958          ?        ? 
1 1 1    1   25   10 o 97.07714 1.208125   122.5372   340.3   94.30624 2.345627          ?        ? 
1 1 1    1   25   11 o 34.21305 1.801883   18.42406    25.4   11.72814 1.232958          ?        ? 
1 1 1    1   25   12 o 71.46927 1.199195   59.97240    55.2   51.12265 1.714112          ?        ? 
1 1 1    1   25   13 o 36.12892 1.747949   48.39280   257.6   13.08138 1.263030          ?        ? 
1 1 1    1   25   14 o 98.20653 1.255474   100.4444   230.6   96.59174 2.465916          ?        ? 
1 1 1    1   25   15 o 38.63021 1.712616   53.70187    88.5   14.97593 1.323174          ?        ? 
1 1 1    1   25   16 o 11.47383 4.114481  0.8026828   238.6   1.172814 1.202886          ?        ? 
1 1 1    1   25   17 o 42.51878 1.520625   46.99846   215.6   18.19365 1.293102          ?        ? 
1 1 1    1   25   18 o 28.81003 1.983236   28.80493    72.3   8.420200 1.142741          ?        ? 
1 1 1    1   25   19 o 70.44787 1.301956   68.80013    87.9   50.07012 1.834401          ?        ? 
1 1 1    1   25   20 o 21.62947 2.989214   15.67251   162.5   4.961904 1.293102          ?        ? 
1 1 1    1   25   21 f 30.05302 2.051305   30.22877     3.3   9.412581 1.232958          ?        ? 
1 1 1    1   26    0 o 251.0394 2.654026   218.0340   180.0   630.8234 13.32196   630.8234 13.32196 
1 1 1    1   26    1 o 178.8738 1.487856   192.8317   225.5   320.0879 5.322770          ?        ? 
1 1 1    1   26    2 o 68.31126 0.9464782   37.03704   206.5   46.67197 1.293102          ?        ? 
1 1 1    1   26    3 o 182.6278 1.374941   179.3763   304.4   333.6505 5.022048          ?        ? 
1 1 1    1   26    4 o 52.53558 1.001726   17.65962   279.0   27.60623 1.052525          ?        ? 
1 1 1    1   26    5 o 169.5187 1.303869   191.7556   287.8   287.4897 4.420605          ?        ? 
1 1 1    1   26    6 o 182.7582 1.382187   198.4975   285.2   334.1918 5.052120          ?        ? 
1 1 1    1   26    7 o 135.0481 1.291528   111.0234    14.1   182.4778 3.488369          ?        ? 
1 1 1    1   26    8 o 176.2697 1.492777   150.3545   325.8   311.0061 5.262625          ?        ? 
1 1 1    1   26    9 o 18.66485 3.343340   40.72800    22.7   3.608657 1.202886          ?        ? 
1 1 1    1   26   10 o 32.17866 1.915801   60.65747   245.8   10.37489 1.232958          ?        ? 
1 1 1    1   26   11 o 89.90213 1.254370   107.2746   303.9   80.89407 2.255411          ?        ? 
1 1 1    1   26   12 o 169.2149 1.510584   140.2052   330.4   286.7680 5.112265          ?        ? 
1 1 1    1   26   13 o 28.11913 2.192383   39.82744   186.7   7.939046 1.232958          ?        ? 
1 1 1    1   26   14 o 146.8755 1.382034   134.0705    10.7   216.1887 4.059740          ?        ? 
1 1 1    1   26   15 o 61.11111 1.279433   69.03863   310.8   37.43982 1.563751          ?        ? 
1 1 1    1   26   16 f 72.08946 1.230594   62.55362   172.6   52.14510 1.774257          ?        ? 
1 1 1    1   26   17 o 51.76424 1.365219   57.52800   353.3   26.94464 1.413391          ?        ? 
1 1 1    1   26   18 o 56.12280 1.312778   49.59407   357.2   31.72611 1.473535          ?        ? 
1 1 1    1   26   19 o 14.14973 3.760325   14.18855    90.4   2.255411 1.082597          ?        ? 
1 1 1    1   26   20 o 18.17648 3.261839   16.93832   191.5   3.668802 1.142741          ?        ? 
1 1 1    1   26   21 o 12.72701 4.077836   12.88507   265.2   1.984761 1.172814          ?        ? 
1 1 1    1   27    0 o 38.16049 1.621815   64.88985   180.0   14.64513 1.232958   14.64513 1.232958 
1 1 1    1   27    1 o 65.56999 0.9631159   66.26146   254.7   43.00317 1.263030          ?        ? 
1 1 1    1   27    2 o 257.2672 1.829340   244.0119   113.9   662.3991 9.412581          ?        ? 
1 1 1    1   27    3 o 63.09153 1.000951   35.94690     0.4   39.81552 1.263030          ?        ? 
1 1 1    1   27    4 o 123.0532 1.160821   157.8806    44.5   151.4734 2.856854          ?        ? 
1 1 1    1   27    5 o 76.13373 0.9282290   127.1571   266.7   57.97910 1.413391          ?        ? 
1 1 1    1   27    6 o 93.33764 1.030998   113.0343    80.1   87.14907 1.924617          ?        ? 
1 1 1    1   27    7 o 42.00215 1.181345   50.36574    42.1   17.65235 0.9923807          ?        ? 
1 1 1    1   27    8 o 149.4232 1.298094   155.5389   266.6   223.4360 3.879307          ?        ? 
1 1 1    1   27    9 o 110.8718 1.301921   121.4699   213.0   123.0251 2.886926          ?        ? 
1 1 1    1   27   10 o 201.3873 1.709770   177.4842   228.8   406.2446 6.886521          ?        ? 
1 1 1    1   27   11 o 50.58740 1.367256   45.23738   224.2   25.62147 1.383319          ?        ? 
1 1 1    1   27   12 o 15.06098 4.017751   28.69914   285.1   2.375700 1.232958          ?        ? 
1 1 1    1   27   13 o 32.24083 2.005380   23.15344   326.1   10.43503 1.293102          ?        ? 
1 1 1    1   27   14 o 46.55862 1.582452   53.79218   286.1   21.74216 1.473535          ?        ? 
1 1 1    1   27   15 o 50.02399 1.382655   45.64537    59.8   25.11024 1.383319          ?        ? 
1 1 1    1   27   16 o 32.37030 1.997359   34.44354    56.5   10.58539 1.293102          ?        ? 
1 1 1    1   27   17 o 33.68599 1.874711   24.98100   130.4   11.48756 1.263030          ?        ? 
1 1 1    1   27   18 o 31.95335 1.929309   34.70729   127.9   10.40496 1.232958          ?        ? 
1 1 1    1   27   19 o 13.56855 3.894975   11.88433   140.1   2.074978 1.112669          ?        ? 
1 1 1    1   27   20 o 8.413013 3.678120   7.193503   211.9       0.03 1.172814          ?        ? 
1 1 1    1   27   21 f 10.73655 4.070122   7.381563   302.2   1.263030 1.202886          ?        ? 
1 1 1    1   28    0 o 74.46295 1.333673   89.42800   360.0   55.51318 1.984761   55.51318 1.984761 
1 1 1    1   28    1 o 202.8620 1.623221   211.6886   357.7   411.8080 6.585800          ?        ? 
1 1 1    1   28    2 o 45.08053 1.067322   36.34170   285.4   20.32877 0.9623086          ?        ? 
1 1 1    1   28    3 o 138.8050 1.267404   144.2129    42.3   192.7625 3.518441          ?        ? 
1 1 1    1   28    4 o 96.42623 1.044754   73.53858   344.4   93.01314 2.014834          ?        ? 
1 1 1    1   28    5 o 217.2873 1.660777   236.1537    34.6   472.5837 7.217315          ?        ? 
1 1 1    1   28    6 o 112.2085 1.098810   119.1064   108.1   125.9722 2.465916          ?        ? 
1 1 1    1   28    7 o 38.95451 1.350967   36.70066    15.8   15.18643 1.052525          ?        ? 
1 1 1    1   28    8 o 108.8583 1.146439   123.6654   356.5   118.5745 2.495988          ?        ? 
1 1 1    1   28    9 o 130.0297 1.295119   118.6343     7.4   169.2460 3.368080          ?        ? 
1 1 1    1   28   10 o 123.0730 1.319458   90.44898   291.9   151.6238 3.247792          ?        ? 
1 1 1    1   28   11 o 58.69143 1.409037   53.03202   193.0   34.49275 1.653968          ?        ? 
1 1 1    1   28   12 o 73.76536 1.263786   85.74207   228.1   54.49073 1.864473          ?        ? 
1 1 1    1   28   13 o 71.24833 1.224018   44.11930    23.5   50.85200 1.744184          ?        ? 
1 1 1    1   28   14 o 54.37290 1.382681   56.35564   291.1   29.65113 1.503607          ?        ? 
1 1 1    1   28   15 o 21.09983 2.992986   29.78343    72.6   4.540894 1.263030          ?        ? 
1 1 1    1   28   16 o 29.43671 2.145332   31.43529   206.8   8.781067 1.263030          ?        ? 
1 1 1    1   28   17 o 66.87299 1.259133   63.81989    86.8   44.98793 1.684040          ?        ? 
1 1 1    1   28   18 o 32.90350 1.873597   23.43307     4.2   11.03648 1.232958          ?        ? 
1 1 1    1   28   19 o 29.18534 2.215329   20.57884     4.9   8.811138 1.293102          ?        ? 
1 1 1    1   28   20 o 44.68681 1.581441   40.09281   211.0   20.47913 1.413391          ?        ? 
1 1 1    1   29    0 o 148.3613 1.733576   142.6519   180.0   220.3085 5.142337   220.3085 5.142337 
1 1 1    1   29    1 o 14.43736 2.914067   43.72362   299.4   2.165194 0.8119479          ?        ? 
1 1 1    1   29    2 o 121.7871 1.074119   119.1190   335.9   148.3760 2.616277          ?        ? 
1 1 1    1   29    3 o 129.1606 1.164138   157.6349    85.0   166.9004 3.007215          ?        ? 
1 1 1    1   29    4 o 95.84307 1.051111   107.3962    26.0   91.90047 2.014834          ?        ? 
1 1 1    1   29    5 o 67.77409 0.9539799   59.49800    26.3   45.95024 1.293102          ?        ? 
1 1 1    1   29    6 o 26.28195 1.716320   50.80050   270.3   6.916593 0.9021643          ?        ? 
1 1 1    1   29    7 o 77.37965 0.9910095   79.07464   213.3   59.90371 1.533679          ?        ? 
1 1 1    1   29    8 o 104.0041 1.185490   104.3672    64.1   108.2597 2.465916          ?        ? 
1 1 1    1   29    9 o 96.21395 1.250220   96.25476   337.8   92.65228 2.405771          ?        ? 
1 1 1    1   29   10 o 112.9616 1.304457   138.1283    25.9   127.7465 2.947070          ?        ? 
1 1 1    1   29   11 o 135.2100 1.412308   133.0373   233.9   183.1093 3.819162          ?        ? 
1 1 1    1   29   12 o 102.0661 1.311121   103.4255   288.3   104.3503 2.676421          ?        ? 
1 1 1    1   29   13 o 85.12209 1.236489   78.44727   254.2   72.59415 2.105050          ?        ? 
1 1 1    1   29   14 o 34.03465 1.988043   28.95801   252.1   11.66799 1.353247          ?        ? 
1 1 1    1   29   15 o 34.25415 1.975303   41.03436   354.0   11.84843 1.353247          ?        ? 
1 1 1    1   29   16 o 38.93700 1.853588   34.52174    94.7   15.33679 1.443463          ?        ? 
1 1 1    1   29   17 o 33.78025 1.869480   32.13232   330.6   11.60785 1.263030          ?        ? 
1 1 1    1   29   18 o 13.19824 3.991134   15.60997   165.4   1.954689 1.142741          ?        ? 
1 1 1    1   29   19 o 25.73643 2.512202   23.61280   142.3   6.976738 1.293102          ?        ? 
1 1 1    1   29   20 o 22.85106 2.632013   16.35082   272.2   5.653563 1.202886          ?        ? 
1 1 1    1   30    0 o 88.54697 1.342181   102.5554     0.0   78.48830 2.375700   78.48830 2.375700 
1 1 1    1   30    1 o 91.80814 0.9990404   90.59309   192.7   84.32229 1.834401          ?        ? 
1 1 1    1   30    2 o 102.3354 1.013813   72.76968   285.0   104.7713 2.074978          ?        ? 
1 1 1    1   30    3 o 58.61607 1.000420   80.89122   134.9   34.37246 1.172814          ?        ? 
1 1 1    1   30    4 o 69.46008 0.9741182   83.18340   224.4   48.26579 1.353247          ?        ? 
1 1 1    1   30    5 o 127.4971 1.155740   146.8595   193.5   162.6602 2.947070          ?        ? 
1 1 1    1   30    6 o 87.28829 1.050771   95.68171   179.3   76.23289 1.834401          ?        ? 
1 1 1    1   30    7 o 26.67224 1.747578   13.93013   139.3   7.127099 0.9322364          ?        ? 
1 1 1    1   30    8 o 19.19010 2.820718   26.21055   155.3   3.698874 1.082597          ?        ? 
1 1 1    1   30    9 o 60.95417 1.356731   43.54398   155.8   37.19924 1.653968          ?        ? 
1 1 1    1   30   10 o 89.31624 1.279433   66.47561   350.4   79.87162 2.285483          ?        ? 
1 1 1    1   30   11 o 67.05576 1.390241   79.00293    56.0   45.04807 1.864473          ?        ? 
1 1 1    1   30   12 f 74.06882 1.278909   61.69133   243.6   54.97188 1.894545          ?        ? 
1 1 1    1   30   13 o 52.35949 1.550718   51.51450   143.1   27.51601 1.623896          ?        ? 
1 1 1    1   30   14 o 78.86010 1.315607   65.20753   221.1   62.42978 2.074978          ?        ? 
1 1 1    1   30   15 o 52.60812 1.457645   49.53777   178.7   27.84681 1.533679          ?        ? 
1 1 1    1   30   16 o 80.48870 1.307668   64.61147    12.5   65.19641 2.105050          ?        ? 
1 1 1    1   30   17 o 39.81871 1.774782   35.54617   149.1   16.11867 1.413391          ?        ? 
1 1 1    1   30   18 o 29.55178 2.238739   27.70981    15.6   9.021644 1.323174          ?        ? 
1 1 1    1   30   19 o 23.82742 2.650371   22.62797   102.1   6.044501 1.263030          ?        ? 
1 1 1    1   30   20 o 26.98120 2.452030   24.21984   302.1   7.848830 1.323174          ?        ? 
1 1 1    1   31    0 o 230.3545 2.311209   215.6953   360.0   531.3748 10.64554   531.3748 10.64554 
1 1 1    1   31    1 o 65.90654 0.9810122   71.43636   314.4   43.45425 1.293102          ?        ? 
1 1 1    1   31    2 o 26.79196 1.683648   41.49895   262.2   7.187243 0.9021643          ?        ? 
1 1 1    1   31    3 o 47.85556 1.099689   45.73311   183.1   22.91497 1.052525          ?        ? 
1 1 1    1   31    4 o 189.8207 1.409974   186.7704   177.7   360.6552 5.352841          ?        ? 
1 1 1    1   31    5 o 130.3575 1.176518   143.1792   137.9   170.0580 3.067359          ?        ? 
1 1 1    1   31    6 o 32.37267 1.579192   6.195229   108.1   10.49518 1.022453          ?        ? 
1 1 1    1   31    7 o 105.7835 1.179762   105.9190   229.1   111.9887 2.495988          ?        ? 
1 1 1    1   31    8 o 59.59225 1.185885   38.69231   199.5   35.54527 1.413391          ?        ? 
1 1 1    1   31    9 o 131.0984 1.376317   126.9158   159.8   172.1029 3.608657          ?        ? 
1 1 1    1   31   10 o 251.1487 2.071474   227.1377   262.4   633.2592 10.40496          ?        ? 
1 1 1    1   31   11 o 71.78075 1.361569   66.51801   109.7   51.63387 1.954689          ?        ? 
1 1 1    1   31   12 o 23.24642 2.975337   24.19102   157.8   5.473131 1.383319          ?        ? 
1 1 1    1   31   13 o 67.87795 1.351249   63.42764   116.0   46.25096 1.834401          ?        ? 
1 1 1    1   31   14 o 58.64908 1.435692   51.82774    96.7   34.58297 1.684040          ?        ? 
1 1 1    1   31   15 o 19.18204 3.500475   18.45760     7.2   3.939451 1.293102          ?        ? 
1 1 1    1   31   16 o 8.947672 3.761362   2.642391   217.7  0.2405772 1.142741          ?        ? 
1 1 1    1   31   17 o 36.26912 1.865563   34.34512   106.6   13.44225 1.353247          ?        ? 
1 1 1    1   31   18 o 33.70811 2.007301   31.07960   239.6   11.72814 1.353247          ?        ? 
1 1 1    1   31   19 o 10.54313 4.048628   5.564268    96.7   1.142741 1.202886          ?        ? 
1 1 1    1   32    0 o 70.42996 1.346082   49.08570   180.0   49.67918 1.894545   49.67918 1.894545 
1 1 1    1   32    1 o 154.0880 1.229521   149.8196     5.2   237.6000 3.789090          ?        ? 
1 1 1    1   32    2 o 85.14510 1.024242   93.53057    11.4   72.53401 1.744184          ?        ? 
1 1 1    1   32    3 o 131.7144 1.118735   122.1213    39.0   173.6065 2.947070          ?        ? 
1 1 1    1   32    4 o 77.68413 1.006481   88.75983   147.3   60.38487 1.563751          ?        ? 
1 1 1    1   32    5 o 108.6356 1.079586   100.0448   157.3   118.0933 2.345627          ?        ? 
1 1 1    1   32    6 o 89.81528 0.9877254   74.98925   150.5   80.71364 1.774257          ?        ? 
1 1 1    1   32    7 o 37.92342 1.546292   22.08951    29.0   14.40456 1.172814          ?        ? 
1 1 1    1   32    8 o 16.50153 3.650809   20.22104   155.5   2.856854 1.172814          ?        ? 
1 1 1    1   32    9 o 79.72826 1.301281   79.58755   169.8   63.66273 2.074978          ?        ? 
1 1 1    1   32   10 o 109.5847 1.358375   81.06618   181.7   120.3186 2.977142          ?        ? 
1 1 1    1   32   11 o 60.71847 1.411525   55.76332    42.4   36.95867 1.714112          ?        ? 
1 1 1    1   32   12 o 100.9490 1.280946   89.47291    49.2   102.1851 2.586205          ?        ? 
1 1 1    1   32   13 o 14.46347 4.214299   18.26267   262.4   2.225339 1.293102          ?        ? 
1 1 1    1   32   14 o 26.74545 2.417424   15.75675   289.4   7.277459 1.293102          ?        ? 
1 1 1    1   32   15 o 15.74245 4.213556   12.00437   335.4   2.736565 1.353247          ?        ? 
1 1 1    1   32   16 o 12.88300 4.336610   12.16256     5.6   1.774257 1.323174          ?        ? 
1 1 1    1   32   17 o 69.68714 1.316169   55.35865   331.3   49.10781 1.834401          ?        ? 
1 1 1    1   32   18 o 15.69789 4.008392   7.950930   337.5   2.916998 1.263030          ?        ? 
1 1 1    1   32   19 o 44.32896 1.662046   40.11311   244.2   20.32877 1.473535          ?        ? 
1 1 1    1   33    0 o 15.63825 4.844651   7.113330   360.0   3.067359 1.323174   3.067359 1.323174 
1 1 1    1   33    1 o 104.8238 0.9897462   79.86971   219.2   109.9438 2.074978          ?        ? 
1 1 1    1   33    2 o 132.6774 1.133280   115.2542     6.9   176.1626 3.007215          ?        ? 
1 1 1    1   33    3 o 77.99500 1.002469   73.48177   307.6   60.86602 1.563751          ?        ? 
1 1 1    1   33    4 o 45.26884 1.195742   48.15323   216.8   20.50920 1.082597          ?        ? 
1 1 1    1   33    5 o 89.74200 1.055551   104.9931    84.0   80.59335 1.894545          ?        ? 
1 1 1    1   33    6 o 18.62815 2.825092   7.772511   290.5   3.488369 1.052525          ?        ? 
1 1 1    1   33    7 o 145.6840 1.186917   132.4203    75.6   212.4597 3.458297          ?        ? 
1 1 1    1   33    8 o 133.1989 1.241728   132.2395    72.8   177.6662 3.307936          ?        ? 
1 1 1    1   33    9 o 65.24022 1.359787   49.40044   353.6   42.64230 1.774257          ?        ? 
1 1 1    1   33   10 o 111.3090 1.350840   100.5803    78.6   124.1679 3.007215          ?        ? 
1 1 1    1   33   11 o 111.1360 1.312356   100.0574   353.3   123.8371 2.916998          ?        ? 
1 1 1    1   33   12 o 31.93538 2.259974   25.46330   129.7   10.31474 1.443463          ?        ? 
1 1 1    1   33   13 o 48.55677 1.641196   39.16039    94.1   23.75699 1.593824          ?        ? 
1 1 1    1   33   14 o 10.06289 4.121937   11.89916   341.7  0.4811543 1.323174          ?        ? 
1 1 1    1   33   15 o 19.71826 3.561915   21.90708   101.2   4.240172 1.353247          ?        ? 
1 1 1    1   33   16 o 38.13787 1.931853   36.38212   261.4   14.88571 1.473535          ?        ? 
1 1 1    1   33   17 o 28.69323 2.567740   25.02892    20.9   8.660777 1.473535          ?        ? 
1 1 1    1   33   18 o 19.30258 3.561180   16.98861    84.0   4.330389 1.323174          ?        ? 
1 1 1    1   34    0 o 65.87806 1.416552   12.59825   180.0   43.48432 1.864473   43.48432 1.864473 
1 1 1    1   34    1 o 107.4770 1.119203   97.96088   159.3   115.5973 2.405771          ?        ? 
1 1 1    1   34    2 o 119.7237 1.105190   97.73093   137.5   143.4441 2.646349          ?        ? 
1 1 1    1   34    3 o 188.2648 1.437599   160.9190   125.1   354.9114 5.412986          ?        ? 
1 1 1    1   34    4 o 24.42971 2.031094   27.73331    62.4   5.984357 0.9923807          ?        ? 
1 1 1    1   34    5 o 87.63828 1.063732   99.13568   205.9   76.86440 1.864473          ?        ? 
1 1 1    1   34    6 o 42.16284 1.355152   20.76383   306.7   17.80271 1.142741          ?        ? 
1 1 1    1   34    7 o 58.10035 1.190456   46.86802   162.0   33.80109 1.383319          ?        ? 
1 1 1    1   34    8 o 64.20978 1.194273   66.69518   229.8   41.28905 1.533679          ?        ? 
1 1 1    1   34    9 o 42.99303 1.783637   42.02126   107.5   18.55451 1.533679          ?        ? 
1 1 1    1   34   10 o 55.57671 1.569169   39.88855   322.7   31.00438 1.744184          ?        ? 
1 1 1    1   34   11 o 41.03224 1.832227   40.89532   163.2   16.96069 1.503607          ?        ? 
1 1 1    1   34   12 o 29.31899 2.359083   24.26030    37.3   8.720922 1.383319          ?        ? 
1 1 1    1   34   13 o 43.14211 1.742621   46.66372   354.0   18.79509 1.503607          ?        ? 
1 1 1    1   34   14 o 55.44442 1.437317   53.53490     5.3   31.00438 1.593824          ?        ? 
1 1 1    1   34   15 o 18.25817 3.586624   15.08228    24.2   3.668802 1.263030          ?        ? 
1 1 1    1   34   16 o 21.59389 3.272664   21.20532   144.7   4.991976 1.413391          ?        ? 
1 1 1    1   34   17 o 30.91175 2.237529   21.51312   174.8   9.983953 1.383319          ?        ? 
1 1 1    1   34   18 o 9.521081 4.051654   16.05954   105.8  0.5412986 1.353247          ?        ? 
1 1 1    1   35    0 o 31.50716 2.315662   34.17414   360.0   10.10424 1.443463   10.10424 1.443463 
1 1 1    1   35    1 o 140.2001 1.147545   137.9999    50.5   196.7320 3.217719          ?        ? 
1 1 1    1   35    2 o 60.52153 1.093143   66.29697    68.9   36.65794 1.323174          ?        ? 
1 1 1    1   35    3 o 16.29103 3.253206   1.962005   334.5   2.766637 1.022453          ?        ? 
1 1 1    1   35    4 o 97.95247 0.9977745   113.8790    46.2   96.02036 1.954689          ?        ? 
1 1 1    1   35    5 o 28.23537 1.970347   35.00890   315.3   7.999191 1.112669          ?        ? 
1 1 1    1   35    6 o 72.39964 1.079944   63.02329   278.5   52.47589 1.563751          ?        ? 
1 1 1    1   35    7 o 65.62506 1.099780   75.78196   116.5   43.12346 1.443463          ?        ? 
1 1 1    1   35    8 o 42.97625 1.574412   64.30271   227.9   18.52444 1.353247          ?        ? 
1 1 1    1   35    9 o 43.07883 1.745181   40.27291    39.8   18.64473 1.503607          ?        ? 
1 1 1    1   35   10 f 53.80779 1.592811   52.04950    94.9   29.10984 1.714112          ?        ? 
1 1 1    1   35   11 o 32.23831 2.285379   22.46169    28.2   10.52525 1.473535          ?        ? 
1 1 1    1   35   12 o 43.30384 1.701391   38.93862   112.5   18.91538 1.473535          ?        ? 
1 1 1    1   35   13 o 14.31164 4.346290   8.878613   266.0   2.225339 1.353247          ?        ? 
1 1 1    1   35   14 o 9.348012 4.062274   14.21902   196.6   0.000000 1.413391          ?        ? 
1 1 1    1   35   15 o 39.80280 1.851045   27.34573   299.9   16.17881 1.473535          ?        ? 
1 1 1    1   35   16 o 17.00793 3.960191   18.28963   124.7   3.368080 1.323174          ?        ? 
1 1 1    1   35   17 o 13.59407 4.213300   15.52478   254.7   2.285483 1.263030          ?        ? 
1 1 1    1   36    0 f 49.51131 1.705090   93.12817   180.0   24.62909 1.684040   24.62909 1.684040 
1 1 1    1   36    1 o 73.39745 1.044777   69.50491    76.3   53.91936 1.533679          ?        ? 
1 1 1    1   36    2 o 61.22892 1.129629   53.68264    42.2   37.53004 1.383319          ?        ? 
1 1 1    1   36    3 o 63.23205 1.093843   50.13586    91.2   40.02603 1.383319          ?        ? 
1 1 1    1   36    4 o 50.54830 1.279076   45.61662    62.4   25.59139 1.293102          ?        ? 
1 1 1    1   36    5 o 69.30305 1.084806   65.65160   149.7   48.08536 1.503607          ?        ? 
1 1 1    1   36    6 o 110.8176 1.126169   103.8022   172.0   122.9951 2.495988          ?        ? 
1 1 1    1   36    7 o 49.24520 1.251856   47.11367    42.2   24.29829 1.232958          ?        ? 
1 1 1    1   36    8 o 60.98849 1.282006   51.93361   261.1   37.28946 1.563751          ?        ? 
1 1 1    1   36    9 o 89.55946 1.376692   65.09115    27.3   80.53320 2.465916          ?        ? 
1 1 1    1   36   10 o 11.67976 4.380552   24.29279   148.3   1.112669 1.383319          ?        ? 
1 1 1    1   36   11 o 46.61572 1.741790   44.46077    30.4   21.92259 1.623896          ?        ? 
1 1 1    1   36   12 o 10.43810 4.207796   6.246363    90.5  0.6315150 1.353247          ?        ? 
1 1 1    1   36   13 o 47.14483 1.722242   40.64069   185.0   22.55411 1.623896          ?        ? 
1 1 1    1   36   14 o 34.12994 2.202769   27.61367   185.8   11.99879 1.503607          ?        ? 
1 1 1    1   36   15 o 10.00795 4.114448   2.300279    89.0  0.6014429 1.323174          ?        ? 
1 1 1    1   36   16 o 18.23794 4.062746   14.55941   295.7   3.939451 1.443463          ?        ? 
1 1 1    1   36   17 o 15.02738 4.414753   19.15047     3.2   2.916998 1.413391          ?        ? 
1 1 1    1   37    0 o 34.16819 2.400208   13.43920   180.0   11.87850 1.623896   11.87850 1.623896 
1 1 1    1   37    1 o 34.42171 1.616232   28.03342   237.1   11.87850 1.112669          ?        ? 
1 1 1    1   37    2 o 53.60966 1.177987   56.53016    69.9   28.77904 1.263030          ?        ? 
1 1 1    1   37    3 o 100.4619 1.047686   80.84828    75.5   101.0424 2.105050          ?        ? 
1 1 1    1   37    4 o 6.989761 3.258362   7.051751   330.7  -1.022453 1.112669          ?        ? 
1 1 1    1   37    5 o 61.70015 1.169740   59.73158   170.5   38.13148 1.443463          ?        ? 
1 1 1    1   37    6 o 57.35454 1.153505   63.38863    29.6   32.95907 1.323174          ?        ? 
1 1 1    1   37    7 o 71.15697 1.119935   72.48123   220.2   50.73171 1.593824          ?        ? 
1 1 1    1   37    8 o 64.85160 1.205638   62.07111    27.5   42.19122 1.563751          ?        ? 
1 1 1    1   37    9 o 60.16478 1.224583   44.98652    79.4   36.32715 1.473535          ?        ? 
1 1 1    1   37   10 o 35.61414 2.068750   28.28522   250.6   12.84081 1.473535          ?        ? 
1 1 1    1   37   11 o 31.90728 2.309090   23.17759   230.8   10.37489 1.473535          ?        ? 
1 1 1    1   37   12 o 54.14368 1.582929   49.92323    53.1   29.65113 1.714112          ?        ? 
1 1 1    1   37   13 o 24.01190 3.256201   18.75009   305.9   6.104645 1.563751          ?        ? 
1 1 1    1   37   14 o 35.41131 2.207983   27.23225   247.2   12.93102 1.563751          ?        ? 
1 1 1    1   37   15 o 9.840528 4.137626   4.845826   214.0  0.5112265 1.383319          ?        ? 
1 1 1    1   37   16 o 12.54245 4.463744   9.002072   172.9   1.924617 1.413391          ?        ? 
1 1 1    1   38    0 o 69.33241 1.672053   91.10469    -0.0   48.23572 2.315555   48.23572 2.315555 
1 1 1    1   38    1 o 48.29050 1.276605   54.71847   329.1   23.36606 1.232958          ?        ? 
1 1 1    1   38    2 o 30.02752 1.802675   17.35405    49.7   9.051716 1.082597          ?        ? 
1 1 1    1   38    3 o 46.48134 1.326293   29.66689   324.7   21.65195 1.232958          ?        ? 
1 1 1    1   38    4 o 32.96791 1.733112   21.85917   162.1   10.91619 1.142741          ?        ? 
1 1 1    1   38    5 o 69.89117 1.032651   55.43302    85.2   48.92738 1.443463          ?        ? 
1 1 1    1   38    6 o 65.29666 1.105312   58.24398    36.8   42.73252 1.443463          ?        ? 
1 1 1    1   38    7 o 25.34346 2.254509   6.803909     8.3   6.495584 1.142741          ?        ? 
1 1 1    1   38    8 o 87.82404 1.061482   71.93082   338.8   77.34556 1.864473          ?        ? 
1 1 1    1   38    9 o 7.105753 3.332834   15.15291   150.5  -1.172814 1.202886          ?        ? 
1 1 1    1   38   10 o 35.31871 2.213772   26.27558   305.9   12.69044 1.563751          ?        ? 
1 1 1    1   38   11 o 9.010403 3.998683   1.246883   117.1 -0.3307936 1.443463          ?        ? 
1 1 1    1   38   12 o 12.66221 4.675553   8.271896   280.9   1.563751 1.563751          ?        ? 
1 1 1    1   38   13 o 32.54218 2.125424   35.01329   102.2   10.88612 1.383319          ?        ? 
1 1 1    1   38   14 o 13.53356 4.434074   19.94630   176.9   2.135122 1.383319          ?        ? 
1 1 1    1   38   15 o 15.54290 4.428203   17.78913   318.7   3.007215 1.443463          ?        ? 
1 1 1    1   38   16 o 25.10100 2.995114   23.54099    17.2   7.036882 1.503607          ?        ? 
1 1 1    1   39    0 o 40.82117 2.036650  0.5201767   180.0   16.84040 1.653968   16.84040 1.653968 
1 1 1    1   39    1 o 51.29508 1.231142   49.79479   339.5   26.37327 1.263030          ?        ? 
1 1 1    1   39    2 o 53.44595 1.209729   44.23898   345.8   28.62868 1.293102          ?        ? 
1 1 1    1   39    3 o 116.2765 1.137956   88.55043    85.2   135.4750 2.646349          ?        ? 
1 1 1    1   39    4 o 62.17846 1.184924   54.66928   339.5   38.76299 1.473535          ?        ? 
1 1 1    1   39    5 o 73.48119 1.064049   69.50230    76.2   54.12986 1.563751          ?        ? 
1 1 1    1   39    6 o 40.31219 1.454664   41.90657   168.1   16.32917 1.172814          ?        ? 
1 1 1    1   39    7 o 35.57868 1.648197   29.60529   127.0   12.75059 1.172814          ?        ? 
1 1 1    1   39    8 o 20.53797 2.562389   11.85055   238.3   4.300317 1.052525          ?        ? 
1 1 1    1   39    9 o 49.59093 1.455370   47.33584   166.2   24.77945 1.443463          ?        ? 
1 1 1    1   39   10 o 30.31919 2.380445   24.44625   243.0   9.412581 1.443463          ?        ? 
1 1 1    1   39   11 o 9.343995 4.082860   15.33738   127.0      -0.06 1.443463          ?        ? 
1 1 1    1   39   12 o 22.18402 3.185606   22.43042   255.6   5.232553 1.413391          ?        ? 
1 1 1    1   39   13 o 8.822185 3.933218   3.746853   225.8 -0.2405772 1.413391          ?        ? 
1 1 1    1   39   14 o 27.18424 2.765586   24.14082   156.3   7.908974 1.503607          ?        ? 
1 1 1    1   39   15 o 9.178489 3.981542   10.36982   243.3  0.3307936 1.353247          ?        ? 
1 1 1    1   40    0 o 25.92187 3.089835   16.24059   180.0   7.066954 1.563751   7.066954 1.563751 
1 1 1    1   40    1 o 69.77142 1.099074   52.19676   281.1   48.80709 1.533679          ?        ? 
1 1 1    1   40    2 o 19.59858 2.838648   22.51868    37.7   3.909379 1.112669          ?        ? 
1 1 1    1   40    3 f 31.57737 1.809431   35.72550   278.5   10.04410 1.142741          ?        ? 
1 1 1    1   40    4 o 29.76634 1.869006   28.11321   176.1   8.931427 1.112669          ?        ? 
1 1 1    1   40    5 o 66.38714 1.087156   58.32992    26.2   44.20605 1.443463          ?        ? 
1 1 1    1   40    6 o 25.07332 2.218831   19.98749   306.5   6.375295 1.112669          ?        ? 
1 1 1    1   40    7 o 6.898390 3.197683   4.488810   203.9 -0.8420200 1.052525          ?        ? 
1 1 1    1   40    8 o 20.65102 2.475550   17.19299   164.5   4.360461 1.022453          ?        ? 
1 1 1    1   40    9 o 24.39345 2.650511   23.30292   113.0   6.134717 1.293102          ?        ? 
1 1 1    1   40   10 o 7.467133 3.508856   1.754987   136.3  -1.263030 1.353247          ?        ? 
1 1 1    1   40   11 o 39.42017 1.945298   36.15064   358.5   15.90816 1.533679          ?        ? 
1 1 1    1   40   12 o 21.75344 3.525142   23.74314   247.5   5.142337 1.533679          ?        ? 
1 1 1    1   40   13 o 12.95647 4.645929   12.08556   147.8   1.924617 1.533679          ?        ? 
1 1 1    1   40   14 f 35.15106 2.181555   33.14859     1.6   13.05131 1.533679          ?        ? 
1 1 1    1   41    0 o 96.15665 1.548968   86.91542   180.0   92.80264 2.977142   92.80264 2.977142 
1 1 1    1   41    1 o 22.73331 2.248799   34.83166   137.1   5.232553 1.022453          ?        ? 
1 1 1    1   41    2 o 15.82972 3.421520   9.616770   203.5   2.676421 1.052525          ?        ? 
1 1 1    1   41    3 o 67.32788 1.161296   58.74815   271.7   45.49916 1.563751          ?        ? 
1 1 1    1   41    4 o 23.35276 2.253534   29.45021    73.9   5.533275 1.052525          ?        ? 
1 1 1    1   41    5 o 60.79151 1.162490   55.64595   282.8   37.10903 1.413391          ?        ? 
1 1 1    1   41    6 o 19.74124 2.741969   18.92398   359.1   3.999595 1.082597          ?        ? 
1 1 1    1   41    7 o 7.864555 3.479997   21.25656    39.5 -0.2706493 1.082597          ?        ? 
1 1 1    1   41    8 o 32.76251 1.881660   31.75837   293.8   10.91619 1.232958          ?        ? 
1 1 1    1   41    9 o 97.69978 1.246596   87.78200   274.4   96.23087 2.435844          ?        ? 
1 1 1    1   41   10 o 25.13231 2.752072   16.97518   279.3   6.615872 1.383319          ?        ? 
1 1 1    1   41   11 o 11.48057 4.465439   5.631648   202.2   1.172814 1.473535          ?        ? 
1 1 1    1   41   12 o 14.04825 4.668837   19.65420    96.8   2.375700 1.533679          ?        ? 
1 1 1    1   41   13 o 16.82933 4.412961   15.35685    57.9   3.578585 1.503607          ?        ? 
1 1 1    1   42    0 o 42.43473 1.957770   35.62184   180.0   18.22372 1.653968   18.22372 1.653968 
1 1 1    1   42    1 o 75.58736 1.113969   60.93954   202.6   57.34758 1.684040          ?        ? 
1 1 1    1   42    2 o 29.97663 1.855895   28.79005   231.6   9.081788 1.112669          ?        ? 
1 1 1    1   42    3 o 50.18935 1.258265   41.14794   138.6   25.32075 1.263030          ?        ? 
1 1 1    1   42    4 o 24.99271 2.105664   25.81188   128.6   6.345222 1.052525          ?        ? 
1 1 1    1   42    5 o 23.66282 2.351092   21.74564   204.7   5.713707 1.112669          ?        ? 
1 1 1    1   42    6 o 18.35804 2.866660   11.53499   134.7   3.488369 1.052525          ?        ? 
1 1 1    1   42    7 o 30.42622 1.976725   25.05278   144.3   9.442654 1.202886          ?        ? 
1 1 1    1   42    8 o 78.94661 1.161798   67.70971   198.7   62.79064 1.834401          ?        ? 
1 1 1    1   42    9 o 13.64984 4.149289   17.30007   304.3   2.105050 1.232958          ?        ? 
1 1 1    1   42   10 o 35.61921 2.195096   24.11490   314.0   13.11145 1.563751          ?        ? 
1 1 1    1   42   11 o 13.76044 4.668845   13.18764   179.7   2.255411 1.533679          ?        ? 
1 1 1    1   42   12 o 13.45159 4.621616   15.91284    48.2   2.255411 1.503607          ?        ? 
1 1 1    1   42   13 o 13.08801 4.434077   12.11983   219.6   2.195267 1.383319          ?        ? 
1 1 1    1   43    0 o 32.64780 2.421416   31.88699   180.0   10.94626 1.563751   10.94626 1.563751 
1 1 1    1   43    1 o 59.42120 1.163994   47.71323   291.9   35.48513 1.383319          ?        ? 
1 1 1    1   43    2 o 61.43372 1.223764   54.23449   252.9   37.95105 1.503607          ?        ? 
1 1 1    1   43    3 o 21.74185 2.489662   17.46392    15.7   4.841615 1.082597          ?        ? 
1 1 1    1   43    4 o 20.61782 2.698319   20.64574   242.6   4.390533 1.112669          ?        ? 
1 1 1    1   43    5 o 11.86735 3.807985   8.075410   107.8   1.503607 1.022453          ?        ? 
1 1 1    1   43    6 o 34.05312 1.633726   31.28229   320.6   11.75821 1.112669          ?        ? 
1 1 1    1   43    7 f 32.23988 1.725610   28.73151   168.7   10.58539 1.112669          ?        ? 
1 1 1    1   43    8 f 15.54021 3.878354   4.644895   309.8   2.736565 1.202886          ?        ? 
1 1 1    1   43    9 o 21.72790 3.114075   30.60493     7.5   5.052120 1.353247          ?        ? 
1 1 1    1   43   10 o 13.00312 4.564719   14.64408   329.2   1.954689 1.473535          ?        ? 
1 1 1    1   43   11 o 16.64145 4.563529   14.60231   236.5   3.518441 1.563751          ?        ? 
1 1 1    1   43   12 o 9.561897 4.212957   14.42986   130.6  0.3007214 1.563751          ?        ? 
1 1 1    1   44    0 o 40.90737 2.106957   37.15281   180.0   17.05091 1.714112   17.05091 1.714112 
1 1 1    1   44    1 f 46.98129 1.376189   44.05539    19.0   22.28346 1.293102          ?        ? 
1 1 1    1   44    2 o 25.57073 2.234472   19.70705   223.8   6.706088 1.142741          ?        ? 
1 1 1    1   44    3 o 32.12017 1.825665   22.15550   265.0   10.49518 1.172814          ?        ? 
1 1 1    1   44    4 o 33.43675 1.618873   35.56646   334.0   11.33720 1.082597          ?        ? 
1 1 1    1   44    5 f 14.51893 3.791107   9.042808   217.7   2.375700 1.112669          ?        ? 
1 1 1    1   44    6 o 44.39464 1.456372   34.59547   164.7   19.96791 1.293102          ?        ? 
1 1 1    1   44    7 o 14.54537 3.862409   16.92172    99.1   2.405771 1.142741          ?        ? 
1 1 1    1   44    8 o 7.967570 3.508174   6.075378   195.9      -0.09 1.082597          ?        ? 
1 1 1    1   44    9 o 15.66258 4.085660   9.522006   237.2   2.916998 1.293102          ?        ? 
1 1 1    1   44   10 o 44.97594 1.872157   37.81478    75.6   21.02043 1.684040          ?        ? 
1 1 1    1   44   11 o 11.07522 4.499520   5.872613    36.9   1.232958 1.563751          ?        ? 
1 1 1    1   45    0 o 71.35852 1.708941   50.10912    -0.0   51.45344 2.435844   51.45344 2.435844 
1 1 1    1   45    1 o 22.25725 2.499567   17.64895   275.0   5.142337 1.112669          ?        ? 
1 1 1    1   45    2 o 38.78817 1.666877   32.65545   124.3   15.30672 1.293102          ?        ? 
1 1 1    1   45    3 o 27.68348 2.118256   31.49621   144.0   7.878902 1.172814          ?        ? 
1 1 1    1   45    4 o 22.22562 2.570775   18.88843    78.7   5.142337 1.142741          ?        ? 
1 1 1    1   45    5 o 16.88467 3.414310   9.563594   234.6   3.157575 1.112669          ?        ? 
1 1 1    1   45    6 o 28.55308 2.106403   18.51521    65.8   8.420200 1.202886          ?        ? 
1 1 1    1   45    7 o 11.36262 3.919861   8.736422   186.8   1.413391 1.082597          ?        ? 
1 1 1    1   45    8 o 30.30586 1.736505   26.84200    61.6   9.442654 1.052525          ?        ? 
1 1 1    1   45    9 o 12.46529 4.285604   12.72926   311.5   1.894545 1.293102          ?        ? 
1 1 1    1   45   10 o 9.744590 4.233064   11.89342   217.7  0.4811543 1.533679          ?        ? 
1 1 1    1   46    0 f 21.03986 4.473138   22.03443   180.0   5.202481 1.653968   5.202481 1.653968 
1 1 1    1   46    1 o 42.33084 1.527376   27.84513    19.3   18.19365 1.293102          ?        ? 
1 1 1    1   46    2 o 28.85522 2.084347   22.79283     7.3   8.570561 1.202886          ?        ? 
1 1 1    1   46    3 o 68.53192 1.206714   55.01422   350.0   47.45385 1.653968          ?        ? 
1 1 1    1   46    4 o 45.47307 1.454899   42.24903   209.8   21.02043 1.323174          ?        ? 
1 1 1    1   46    5 o 8.398457 3.626266   7.270014   181.7  0.1202886 1.112669          ?        ? 
1 1 1    1   46    6 o 37.87411 1.667405   26.95964     6.6   14.70528 1.263030          ?        ? 
1 1 1    1   46    7 o 13.47075 4.037253   10.55188   296.7   2.195267 1.172814          ?        ? 
1 1 1    1   46    8 o 38.69078 1.593349   30.87015   314.3   15.42701 1.232958          ?        ? 
1 1 1    1   47    0 o 33.34910 2.601092   25.91297   360.0   11.63792 1.714112   11.63792 1.714112 
1 1 1    1   47    1 o 10.05041 3.886245   1.150305    58.4  0.9021643 1.112669          ?        ? 
1 1 1    1   47    2 o 25.39715 2.368151   23.64932   340.1   6.766232 1.202886          ?        ? 
1 1 1    1   47    3 o 14.68035 3.846054   5.930456   148.9   2.526060 1.142741          ?        ? 
1 1 1    1   47    4 o 21.18566 2.767942   16.09468    79.5   4.811543 1.172814          ?        ? 
1 1 1    1   47    5 o 10.60682 3.980798   3.870178   189.1   1.172814 1.142741          ?        ? 
1 1 1    1   47    6 o 14.15161 3.978677   11.85150   217.1   2.465916 1.172814          ?        ? 
1 1 1    1   47    7 o 31.07810 2.032026   18.19894   209.3   10.16438 1.263030          ?        ? 
1 1 1    1   48    0 o 37.32150 2.397283   35.13663     0.0   14.52485 1.774257   14.52485 1.774257 
1 1 1    1   48    1 o 8.214608 3.587044   13.49044   146.6       0.09 1.112669          ?        ? 
1 1 1    1   48    2 o 49.67092 1.483298   34.97223    55.4   25.29067 1.473535          ?        ? 
1 1 1    1   48    3 o 19.80953 2.960227   7.419075   117.4   4.330389 1.172814          ?        ? 
1 1 1    1   48    4 o 40.18242 1.571620   34.75426    36.3   16.62990 1.263030          ?        ? 
1 1 1    1   48    5 o 28.11443 2.192750   19.02433   259.8   8.390128 1.232958          ?        ? 
1 1 1    1   49    0 o 14.50310 5.862903   2.555458   180.0   3.368080 1.653968   3.368080 1.653968 
1 1 1    1   49    1 o 8.961965 3.764084   4.418117   155.5  0.5112265 1.142741          ?        ? 
1 1 1    1   49    2 o 25.77529 2.275074   25.28328   102.7   7.097026 1.172814          ?        ? 
1 1 1    2    0    0 x        ?      ?   7533.773   180.0          ?        ?          ?        ? 
1 1 1    2    0    1 o 221.9289 2.656723   1491.432   180.0   492.9727 11.78828   492.9727 11.78828 
1 1 1    2    0    2 o 111.8428 1.708271   286.5478     0.0   125.1903 3.819162   125.1903 3.819162 
1 1 1    2    0    3 o 269.9084 2.735896   262.3054   180.0   728.8586 14.76542   728.8586 14.76542 
1 1 1    2    0    4 o 132.2204 1.524299   168.0371   180.0   174.8996 4.029667   174.8996 4.029667 
1 1 1    2    0    5 o 218.9886 2.321342   241.9549   180.0   479.8011 10.16438   479.8011 10.16438 
1 1 1    2    0    6 o 73.07399 1.111707   87.38865   180.0   53.43820 1.623896   53.43820 1.623896 
1 1 1    2    0    7 o 348.9423 3.452302   306.2371     0.0   1218.493 24.08779   1218.493 24.08779 
1 1 1    2    0    8 o 294.5642 3.088994   339.2021     0.0   868.1527 18.19365   868.1527 18.19365 
1 1 1    2    0    9 o 100.9218 1.401086   160.3172   180.0   101.9145 2.826782   101.9145 2.826782 
1 1 1    2    0   10 o 231.0215 4.507721   285.6098     0.0   534.5624 20.80992   534.5624 20.80992 
1 1 1    2    0   11 f 312.5519 5.497670   433.8292     0.0   978.7280 34.34239   978.7280 34.34239 
1 1 1    2    0   12 o 186.3966 2.186753   266.2091   180.0   347.6641 8.149551   347.6641 8.149551 
1 1 1    2    0   13 o 78.16857 1.347376   87.12785     0.0   61.16674 2.105050   61.16674 2.105050 
1 1 1    2    0   14 o 77.88134 1.274986   147.7957     0.0   60.71566 1.984761   60.71566 1.984761 
1 1 1    2    0   15 o 89.57641 1.393973   106.6758   180.0   80.32270 2.495988   80.32270 2.495988 
1 1 1    2    0   16 o 35.39632 2.227071   36.38914   180.0   12.69044 1.563751   12.69044 1.563751 
1 1 1    2    0   17 o 174.7593 2.358424   175.7777     0.0   306.0743 8.239767   306.0743 8.239767 
1 1 1    2    0   18 o 35.05134 1.986631   26.04951     0.0   12.41980 1.383319   12.41980 1.383319 
1 1 1    2    0   19 o 62.04523 2.211438   47.64928     0.0   38.73292 2.736565   38.73292 2.736565 
1 1 1    2    0   20 o 30.47877 3.534073   47.57338   180.0   9.743376 2.105050   9.743376 2.105050 
1 1 1    2    0   21 o 5.854972 4.135122   23.31211   180.0  -1.744184 1.804329  -1.744184 1.804329 
1 1 1    2    0   22 o 40.44830 3.198989   58.95469   180.0   16.96069 2.556132   16.96069 2.556132 
1 1 1    2    0   23 o 7.110054 4.830336   7.429055   180.0 -0.6315150 1.984761 -0.6315150 1.984761 
1 1 1    2    0   24 o 33.58931 3.704407   30.16792   180.0   12.26943 2.435844   12.26943 2.435844 
1 1 1    2    0   25 o 6.464965 4.611897   8.471787     0.0  -2.044906 2.405771  -2.044906 2.405771 
1 1 1    2    1    0 x        ?      ?   734.8280   180.0          ?        ?          ?        ? 
1 1 1    2    1    1 o 129.5280 1.126010   1703.312   118.8   167.8026 2.916998          ?        ? 
1 1 1    2    1    2 o 271.6253 2.125668   610.9841    10.8   738.0607 11.54770          ?        ? 
1 1 1    2    1    3 f 176.9742 1.503826   190.3557   107.1   313.2314 5.322770          ?        ? 
1 1 1    2    1    4 o 47.77498 0.5665085   121.6383   295.3   22.82476 0.5412986          ?        ? 
1 1 1    2    1    5 o 132.6994 1.008453   133.5377   147.5   176.1025 2.676421          ?        ? 
1 1 1    2    1    6 o 148.5509 1.123523   143.8945   317.2   220.6995 3.338008          ?        ? 
1 1 1    2    1    7 o 146.5143 1.149403   183.4824   103.0   214.6850 3.368080          ?        ? 
1 1 1    2    1    8 o 104.5935 0.9487974   256.5927   230.4   109.4025 1.984761          ?        ? 
1 1 1    2    1    9 o 284.3962 2.553629   258.9869   107.7   809.0008 14.52485          ?        ? 
1 1 1    2    1   10 o 31.35728 1.342623   120.5105   178.9   9.833591 0.8420200          ?        ? 
1 1 1    2    1   11 o 157.3654 1.500116   121.5239    78.5   247.6742 4.721327          ?        ? 
1 1 1    2    1   12 f 356.3995 2.341479   394.7873   123.5   1270.909 16.69004          ?        ? 
1 1 1    2    1   13 o 92.76277 1.102223   87.52509    61.5   86.06648 2.044906          ?        ? 
1 1 1    2    1   14 o 16.71141 2.429322   10.39754   195.3   2.796710 0.8119479          ?        ? 
1 1 1    2    1   15 o 81.89513 1.028169   88.45868   168.3   67.09096 1.684040          ?        ? 
1 1 1    2    1   16 o 85.26891 1.075656   100.3179   305.2   72.74451 1.834401          ?        ? 
1 1 1    2    1   17 o 101.8501 1.107221   124.1679   208.9   103.8090 2.255411          ?        ? 
1 1 1    2    1   18 o 27.87350 1.941983   32.04721   346.8   7.788685 1.082597          ?        ? 
1 1 1    2    1   19 o 34.67051 1.821476   29.56068    29.9   12.05893 1.263030          ?        ? 
1 1 1    2    1   20 o 86.34581 1.340861   88.39975   130.0   74.75935 2.315555          ?        ? 
1 1 1    2    1   21 o 42.82635 1.474595   50.49359    69.2   18.43423 1.263030          ?        ? 
1 1 1    2    1   22 o 24.04152 2.626768   22.19337   324.8   5.924213 1.263030          ?        ? 
1 1 1    2    1   23 o 30.18140 3.985520   29.39096   275.4   9.893736 2.405771          ?        ? 
1 1 1    2    1   24 x        ?      ?   17.03703   341.4          ?        ?          ?        ? 
1 1 1    2    1   25 x        ?      ?   19.59986   111.6          ?        ?          ?        ? 
1 1 1    2    2    0 o 91.75929 1.869783   408.8472     0.0   84.32229 3.428224   84.32229 3.428224 
1 1 1    2    2    1 o 291.9116 2.529091   2997.341   222.3   852.7258 14.76542          ?        ? 
1 1 1    2    2    2 o 156.5888 1.488351   460.4437    23.1   245.2383 4.661182          ?        ? 
1 1 1    2    2    3 o 170.0349 1.406026   314.0385   177.4   289.1437 4.781471          ?        ? 
1 1 1    2    2    4 o 82.27428 0.8406750   484.2279   172.6   67.69240 1.383319          ?        ? 
1 1 1    2    2    5 o 190.2916 1.438091   105.0651   198.4   362.1588 5.473131          ?        ? 
1 1 1    2    2    6 o 276.2333 1.975900   460.8800   297.2   763.3213 10.91619          ?        ? 
1 1 1    2    2    7 o 92.11897 0.8650899   177.0795   171.4   84.86359 1.593824          ?        ? 
1 1 1    2    2    8 o 208.2881 1.494309   303.1463    20.3   433.8809 6.224934          ?        ? 
1 1 1    2    2    9 o 185.4681 1.815989   350.3765    62.2   344.0253 6.736160          ?        ? 
1 1 1    2    2   10 o 222.3838 1.899930   323.9403   140.8   494.6266 8.450273          ?        ? 
1 1 1    2    2   11 o 266.4572 2.189469   298.1572   120.0   710.2138 11.66799          ?        ? 
1 1 1    2    2   12 o 235.5220 1.813098   232.7266   164.2   554.8912 8.540489          ?        ? 
1 1 1    2    2   13 o 269.1986 2.055462   332.6207   190.7   725.1898 11.06655          ?        ? 
1 1 1    2    2   14 o 54.00329 0.9466581   88.40663   177.2   29.16998 1.022453          ?        ? 
1 1 1    2    2   15 o 178.0829 1.553567   189.6325   276.8   317.3814 5.533275          ?        ? 
1 1 1    2    2   16 o 102.2568 1.102817   125.5608   227.8   104.6210 2.255411          ?        ? 
1 1 1    2    2   17 o 35.85479 1.425825   44.90628    32.9   12.87088 1.022453          ?        ? 
1 1 1    2    2   18 o 63.43312 1.042968   81.62926     3.5   40.26660 1.323174          ?        ? 
1 1 1    2    2   19 f 28.23549 1.863833   12.42925   262.5   7.999191 1.052525          ?        ? 
1 1 1    2    2   20 o 63.52726 1.207103   60.21971    39.7   40.44703 1.533679          ?        ? 
1 1 1    2    2   21 f 41.98978 1.396547   57.43958   188.2   17.71249 1.172814          ?        ? 
1 1 1    2    2   22 f 42.85817 2.034833   45.03814   165.0   18.64473 1.744184          ?        ? 
1 1 1    2    2   23 o 58.34036 1.804111   61.45435    38.7   34.64311 2.105050          ?        ? 
1 1 1    2    2   24 x        ?      ?   54.81316    10.5          ?        ?          ?        ? 
1 1 1    2    2   25 o 13.70964 5.600322   14.29433   330.1   2.435844 2.435844          ?        ? 
1 1 1    2    3    0 o 55.18827 1.063438   957.4203   180.0   30.49315 1.172814   30.49315 1.172814 
1 1 1    2    3    1 o 316.7688 2.458792   2094.389   263.4   1003.959 15.57737          ?        ? 
1 1 1    2    3    2 o 194.2001 1.610454   963.0787    83.1   377.1949 6.255006          ?        ? 
1 1 1    2    3    3 o 133.8730 1.179317   554.8262   108.8   179.2300 3.157575          ?        ? 
1 1 1    2    3    4 o 246.9169 1.960828   264.7152   354.6   609.7729 9.683230          ?        ? 
1 1 1    2    3    5 o 262.8504 2.053620   348.9015   333.3   691.1180 10.79590          ?        ? 
1 1 1    2    3    6 o 85.14590 0.9359369   110.4894   264.0   72.50394 1.593824          ?        ? 
1 1 1    2    3    7 o 227.7725 1.828576   263.0937    87.9   518.9249 8.329985          ?        ? 
1 1 1    2    3    8 o 154.6537 1.283358   382.7255   275.9   239.1938 3.969523          ?        ? 
1 1 1    2    3    9 o 237.5162 2.228352   287.9923   232.1   564.2437 10.58539          ?        ? 
1 1 1    2    3   10 o 95.37402 1.213934   115.8395   210.0   90.96824 2.315555          ?        ? 
1 1 1    2    3   11 o 150.4599 1.449045   146.5309     9.6   226.4132 4.360461          ?        ? 
1 1 1    2    3   12 o 213.0856 1.637074   216.5434   312.0   454.1796 6.976738          ?        ? 
1 1 1    2    3   13 o 52.99356 0.9363220   117.8862   338.8   28.08738 0.9923807          ?        ? 
1 1 1    2    3   14 o 206.8952 1.649719   234.0257    26.7   428.3476 6.826377          ?        ? 
1 1 1    2    3   15 o 31.63592 1.330798   38.40980     5.3   10.01402 0.8420200          ?        ? 
1 1 1    2    3   16 o 19.75306 2.055246   22.43472    50.6   3.909379 0.8119479          ?        ? 
1 1 1    2    3   17 o 52.40820 1.118922   66.95984   322.3   27.48594 1.172814          ?        ? 
1 1 1    2    3   18 o 59.36900 1.089038   62.41175   145.7   35.27463 1.293102          ?        ? 
1 1 1    2    3   19 f 46.27251 1.202301   47.56173    65.3   21.44144 1.112669          ?        ? 
1 1 1    2    3   20 o 47.27950 1.208496   47.72243   134.6   22.40375 1.142741          ?        ? 
1 1 1    2    3   21 o 27.26847 2.150495   29.11790   159.1   7.518036 1.172814          ?        ? 
1 1 1    2    3   22 o 31.57667 2.476119   29.55593   308.1   10.19446 1.563751          ?        ? 
1 1 1    2    3   23 o 8.995378 3.978851   11.03383   328.2 -0.2105050 1.413391          ?        ? 
1 1 1    2    3   24 o 15.98451 4.795170   12.57264   184.2   3.127503 1.653968          ?        ? 
1 1 1    2    3   25 o 26.51092 2.665677   31.30465   138.0   7.638325 1.413391          ?        ? 
1 1 1    2    4    0 o 133.8950 1.392828   118.4929   180.0   179.3503 3.728946   179.3503 3.728946 
1 1 1    2    4    1 o 216.3164 1.633476   560.2165    13.3   468.0128 7.066954          ?        ? 
1 1 1    2    4    2 o 292.8616 2.099884   515.8300   243.8   857.8680 12.29951          ?        ? 
1 1 1    2    4    3 o 113.7785 1.004356   398.7492     7.9   129.4606 2.285483          ?        ? 
1 1 1    2    4    4 o 212.6741 1.923042   345.1947    78.9   452.3753 8.179624          ?        ? 
1 1 1    2    4    5 o 173.7581 1.626848   187.7250   230.9   301.9845 5.653563          ?        ? 
1 1 1    2    4    6 o 379.1435 2.835547   482.9008    35.7   1438.501 21.50158          ?        ? 
1 1 1    2    4    7 o 35.11287 0.7279760   56.37067   257.4   12.32958 0.5112265          ?        ? 
1 1 1    2    4    8 o 602.1913 4.314631   800.3435   117.6   3628.926 51.96467          ?        ? 
1 1 1    2    4    9 o 326.1336 2.798515   399.7066    60.5   1063.953 18.25379          ?        ? 
1 1 1    2    4   10 o 389.9068 2.718709   389.7036    29.3   1520.809 21.20086          ?        ? 
1 1 1    2    4   11 o 112.1519 1.139585   84.85048   271.9   125.7918 2.556132          ?        ? 
1 1 1    2    4   12 o 95.34068 1.009337   87.03091   347.0   90.90809 1.924617          ?        ? 
1 1 1    2    4   13 o 112.9203 1.078568   146.8627    44.0   127.5360 2.435844          ?        ? 
1 1 1    2    4   14 o 43.27753 1.077044   90.27791    16.6   18.73495 0.9322364          ?        ? 
1 1 1    2    4   15 o 154.8758 1.339769   193.6675   115.6   240.0058 4.149956          ?        ? 
1 1 1    2    4   16 o 45.67175 1.053505   51.37441   353.3   20.87007 0.9623086          ?        ? 
1 1 1    2    4   17 o 34.57811 1.348015   44.54011   178.4   11.96871 0.9322364          ?        ? 
1 1 1    2    4   18 o 99.06611 1.062447   104.9826   294.6   98.21563 2.105050          ?        ? 
1 1 1    2    4   19 o 86.18136 1.151503   86.71127   313.6   74.36842 1.984761          ?        ? 
1 1 1    2    4   20 o 27.02219 1.780590   33.48641   218.6   7.337603 0.9623086          ?        ? 
1 1 1    2    4   21 o 49.96776 1.354120   54.99950   256.9   25.08017 1.353247          ?        ? 
1 1 1    2    4   22 o 29.96761 2.408372   29.89826    93.3   9.172004 1.443463          ?        ? 
1 1 1    2    4   23 f 9.084373 3.915674   1.269256     2.8       0.09 1.293102          ?        ? 
1 1 1    2    4   24 o 11.93189 4.398992   10.86022   171.3   1.503607 1.383319          ?        ? 
1 1 1    2    4   25 o 18.68656 4.920584   14.74423   100.3   4.691255 1.864473          ?        ? 
1 1 1    2    5    0 o 606.8130 7.016972   1344.997     0.0   3688.950 85.13425   3688.950 85.13425 
1 1 1    2    5    1 o 83.38142 0.7754140   194.8146   331.9   69.52679 1.293102          ?        ? 
1 1 1    2    5    2 o 80.94772 0.8173018   478.0283   253.6   65.52720 1.323174          ?        ? 
1 1 1    2    5    3 o 206.5339 1.601643   326.5883    33.6   426.6034 6.615872          ?        ? 
1 1 1    2    5    4 o 122.8747 1.162507   302.6301   303.4   150.9922 2.856854          ?        ? 
1 1 1    2    5    5 o 240.8697 2.147389   264.1526   235.4   580.4225 10.34482          ?        ? 
1 1 1    2    5    6 o 156.1826 1.501850   133.9043   343.7   243.9753 4.691255          ?        ? 
1 1 1    2    5    7 o 40.18485 0.7109281   169.6044    59.3   16.14874 0.5713707          ?        ? 
1 1 1    2    5    8 o 329.0717 2.846636   377.3798   350.0   1083.199 18.73495          ?        ? 
1 1 1    2    5    9 o 318.4465 2.474168   407.3407   263.2   1014.333 15.75780          ?        ? 
1 1 1    2    5   10 o 198.2715 1.554633   208.8466   279.1   393.1632 6.164790          ?        ? 
1 1 1    2    5   11 o 256.9617 1.925138   269.7198   137.7   660.4745 9.893736          ?        ? 
1 1 1    2    5   12 o 52.30937 1.006058   79.13676    30.6   27.36565 1.052525          ?        ? 
1 1 1    2    5   13 o 47.23279 1.018687   53.54929   293.5   22.31353 0.9623086          ?        ? 
1 1 1    2    5   14 o 168.8035 1.380653   194.1214   285.3   285.0839 4.661182          ?        ? 
1 1 1    2    5   15 o 96.14474 1.032174   107.9282     4.2   92.47185 1.984761          ?        ? 
1 1 1    2    5   16 o 46.93714 1.057138   56.52358   189.0   22.04288 0.9923807          ?        ? 
1 1 1    2    5   17 o 29.30757 1.539132   35.57468   300.1   8.600634 0.9021643          ?        ? 
1 1 1    2    5   18 o 86.96535 1.089253   85.11244     1.2   75.69159 1.894545          ?        ? 
1 1 1    2    5   19 o 41.36656 1.308541   51.77026   355.4   17.14112 1.082597          ?        ? 
1 1 1    2    5   20 o 21.08400 2.282083   27.79864   353.1   4.480750 0.9623086          ?        ? 
1 1 1    2    5   21 o 90.85855 1.125324   108.1438   313.9   82.81869 2.044906          ?        ? 
1 1 1    2    5   22 o 22.66225 2.587594   31.22422   276.2   5.262625 1.172814          ?        ? 
1 1 1    2    5   23 o 13.76431 4.142357   24.49875   254.9   2.135122 1.232958          ?        ? 
1 1 1    2    5   24 f 36.23723 2.406620   35.37153   150.3   13.77304 1.744184          ?        ? 
1 1 1    2    5   25 o 22.45387 4.173932   16.39201   121.7   6.224934 1.804329          ?        ? 
1 1 1    2    6    0 o 493.2040 4.906371   1311.410     0.0   2434.551 48.38608   2434.551 48.38608 
1 1 1    2    6    1 o 140.1398 1.062204   402.6808   122.0   196.4012 2.977142          ?        ? 
1 1 1    2    6    2 o 371.8237 2.648736   989.7571    30.9   1382.898 19.69725          ?        ? 
1 1 1    2    6    3 o 113.9500 1.029235   229.2468   165.2   129.8515 2.345627          ?        ? 
1 1 1    2    6    4 o 258.1682 2.114162   193.9101   227.2   666.6995 10.91619          ?        ? 
1 1 1    2    6    5 o 316.1527 2.439804   377.4316    71.3   1000.079 15.42701          ?        ? 
1 1 1    2    6    6 o 266.4576 2.364397   329.8608   101.2   710.3041 12.60023          ?        ? 
1 1 1    2    6    7 o 110.0409 1.229767   313.5034    67.4   121.1005 2.706493          ?        ? 
1 1 1    2    6    8 o 399.0699 3.360859   411.2282   267.5   1593.192 26.82435          ?        ? 
1 1 1    2    6    9 o 236.8027 1.942984   164.3099   343.6   560.8455 9.202076          ?        ? 
1 1 1    2    6   10 o 389.6783 2.990404   458.8026   330.5   1519.215 23.30591          ?        ? 
1 1 1    2    6   11 o 169.5501 1.427783   172.5396   219.0   287.5198 4.841615          ?        ? 
1 1 1    2    6   12 o 311.5088 2.225179   365.5431   263.3   970.9093 13.86326          ?        ? 
1 1 1    2    6   13 o 69.31562 0.9978404   78.46561    33.0   48.05529 1.383319          ?        ? 
1 1 1    2    6   14 o 195.9132 1.542647   214.2351   230.1   384.0514 6.044501          ?        ? 
1 1 1    2    6   15 o 82.26155 0.9504753   113.0158    74.3   67.69240 1.563751          ?        ? 
1 1 1    2    6   16 o 106.0812 1.034711   126.3248    36.4   112.5901 2.195267          ?        ? 
1 1 1    2    6   17 o 96.77058 1.072112   87.51469   227.3   93.70480 2.074978          ?        ? 
1 1 1    2    6   18 o 40.57204 1.260046   38.07979   221.3   16.47953 1.022453          ?        ? 
1 1 1    2    6   19 o 66.24926 0.9986334   72.78049   134.7   43.93541 1.323174          ?        ? 
1 1 1    2    6   20 o 81.08349 1.057004   73.85241   226.8   65.85799 1.714112          ?        ? 
1 1 1    2    6   21 f 20.55902 2.559765   10.31480   311.7   4.300317 1.052525          ?        ? 
1 1 1    2    6   22 o 50.89709 1.536189   50.80041   357.8   26.13269 1.563751          ?        ? 
1 1 1    2    6   23 o 16.88280 3.665237   18.53042   298.6   3.187647 1.202886          ?        ? 
1 1 1    2    6   24 o 46.98446 2.176152   50.47763    13.0   22.97512 2.044906          ?        ? 
1 1 1    2    6   25 o 10.10667 4.494089   12.15547   105.4  0.3307936 1.834401          ?        ? 
1 1 1    2    7    0 o 541.8975 6.836545   610.6724   180.0   2940.575 74.06770   2940.575 74.06770 
1 1 1    2    7    1 o 406.4303 2.526789   670.6668   115.5   1652.254 20.53928          ?        ? 
1 1 1    2    7    2 o 117.2282 0.9876269   402.9577   258.5   137.4297 2.315555          ?        ? 
1 1 1    2    7    3 o 178.6737 1.455861   327.0297   250.9   319.2759 5.202481          ?        ? 
1 1 1    2    7    4 o 219.0944 1.667667   300.0766    69.8   480.1319 7.307531          ?        ? 
1 1 1    2    7    5 o 46.94860 0.7686402   215.0423    29.7   22.04288 0.7217315          ?        ? 
1 1 1    2    7    6 o 435.7977 3.650355   525.6285   267.9   1901.041 31.81633          ?        ? 
1 1 1    2    7    7 o 216.5992 2.013148   227.8539   322.9   469.2458 8.720922          ?        ? 
1 1 1    2    7    8 o 44.10908 0.9203864   82.61282   266.4   19.45668 0.8119479          ?        ? 
1 1 1    2    7    9 o 239.6743 2.189467   272.0483   302.9   574.5584 10.49518          ?        ? 
1 1 1    2    7   10 o 306.3355 2.439459   321.1647   170.0   938.7321 14.94586          ?        ? 
1 1 1    2    7   11 o 213.3462 1.768981   245.1918   343.7   455.2923 7.548109          ?        ? 
1 1 1    2    7   12 o 84.22101 0.9997744   77.70911    80.6   70.94019 1.684040          ?        ? 
1 1 1    2    7   13 o 248.6311 1.826358   296.0792   351.2   618.5539 9.081788          ?        ? 
1 1 1    2    7   14 o 99.64989 1.026045   152.7306    67.2   99.32829 2.044906          ?        ? 
1 1 1    2    7   15 o 118.4609 1.155050   126.3601   156.1   140.4068 2.736565          ?        ? 
1 1 1    2    7   16 o 199.9519 1.601727   193.0695    76.3   400.2903 6.405366          ?        ? 
1 1 1    2    7   17 o 111.7776 1.183756   137.6726    98.3   125.0400 2.646349          ?        ? 
1 1 1    2    7   18 f 42.80584 1.229418   50.33126   141.5   18.34401 1.052525          ?        ? 
1 1 1    2    7   19 o 59.36833 1.215684   81.00072   149.1   35.30470 1.443463          ?        ? 
1 1 1    2    7   20 o 102.8215 1.140631   104.5444   210.3   105.9442 2.345627          ?        ? 
1 1 1    2    7   21 o 34.87499 1.508997   37.32690   247.1   12.23936 1.052525          ?        ? 
1 1 1    2    7   22 o 13.57673 4.214384   13.51332   303.1   1.984761 1.263030          ?        ? 
1 1 1    2    7   23 o 19.18848 3.134396   23.54783   274.4   3.909379 1.202886          ?        ? 
1 1 1    2    7   24 o 22.19557 3.658154   28.79327    68.7   5.503202 1.623896          ?        ? 
1 1 1    2    7   25 o 22.10239 3.333429   21.67534   102.9   5.593419 1.473535          ?        ? 
1 1 1    2    8    0 o 123.8112 1.518557   421.4417     0.0   153.3679 3.759018   153.3679 3.759018 
1 1 1    2    8    1 o 671.4001 4.828383   839.9188   358.6   4511.904 64.83555          ?        ? 
1 1 1    2    8    2 o 347.5490 2.357843   239.2067   149.5   1208.208 16.38932          ?        ? 
1 1 1    2    8    3 o 122.4210 1.031710   336.8296   267.3   149.8796 2.526060          ?        ? 
1 1 1    2    8    4 o 231.8474 1.783466   362.5354   107.9   537.6899 8.269840          ?        ? 
1 1 1    2    8    5 o 132.1272 1.251800   217.3129   229.3   174.5989 3.307936          ?        ? 
1 1 1    2    8    6 o 232.1947 1.949165   159.4013   333.5   539.2838 9.051716          ?        ? 
1 1 1    2    8    7 o 144.3958 1.478660   227.9269    37.0   208.5203 4.270245          ?        ? 
1 1 1    2    8    8 o 599.5567 4.860242   685.8001   150.8   3597.711 58.27982          ?        ? 
1 1 1    2    8    9 o 145.3084 1.500416   235.7753    83.5   211.1666 4.360461          ?        ? 
1 1 1    2    8   10 o 185.5012 1.823771   246.3795   106.4   344.1757 6.766232          ?        ? 
1 1 1    2    8   11 o 174.0846 1.589249   172.8047   310.4   303.1272 5.533275          ?        ? 
1 1 1    2    8   12 o 326.8345 2.553287   354.8506    10.7   1069.125 16.69004          ?        ? 
1 1 1    2    8   13 o 223.1167 1.704994   238.3243   292.4   498.0850 7.608253          ?        ? 
1 1 1    2    8   14 o 123.8169 1.190092   188.9973    87.8   153.3679 2.947070          ?        ? 
1 1 1    2    8   15 o 65.76987 0.9601890   90.91984   179.5   43.27382 1.263030          ?        ? 
1 1 1    2    8   16 o 86.14627 1.012339   99.22974   190.3   74.24812 1.744184          ?        ? 
1 1 1    2    8   17 o 88.48119 1.036605   61.34973    57.8   78.33794 1.834401          ?        ? 
1 1 1    2    8   18 o 19.41900 2.477750   7.861314    19.0   3.789090 0.9623086          ?        ? 
1 1 1    2    8   19 o 50.18191 1.258452   26.04493   119.4   25.23053 1.263030          ?        ? 
1 1 1    2    8   20 o 95.13020 1.264463   106.0744   242.2   90.75773 2.405771          ?        ? 
1 1 1    2    8   21 o 19.98458 2.407627   29.97830   294.1   4.059740 0.9623086          ?        ? 
1 1 1    2    8   22 f 16.72387 3.263184   13.25459   327.2   3.007215 1.052525          ?        ? 
1 1 1    2    8   23 o 31.95905 2.211253   31.03666    70.3   10.52525 1.413391          ?        ? 
1 1 1    2    8   24 o 14.36732 4.457865   19.98512   311.9   2.495988 1.413391          ?        ? 
1 1 1    2    9    0 o 587.1369 5.814555   280.1884     0.0   3451.049 68.26377   3451.049 68.26377 
1 1 1    2    9    1 o 211.9991 1.517799   401.1700   235.9   449.4883 6.435439          ?        ? 
1 1 1    2    9    2 o 219.2951 1.515297   507.1514   202.1   480.9739 6.645944          ?        ? 
1 1 1    2    9    3 o 170.6474 1.312868   256.1137   276.2   291.2487 4.480750          ?        ? 
1 1 1    2    9    4 o 259.7393 1.950862   384.2211   182.4   674.8790 10.13431          ?        ? 
1 1 1    2    9    5 o 61.72463 0.8525973   59.16937   156.9   38.10141 1.052525          ?        ? 
1 1 1    2    9    6 o 218.1685 1.840152   329.9722   172.6   476.0721 8.029263          ?        ? 
1 1 1    2    9    7 o 116.2486 1.177031   131.2157   207.7   135.1442 2.736565          ?        ? 
1 1 1    2    9    8 o 471.2034 3.950451   548.0519   149.4   2221.670 37.22932          ?        ? 
1 1 1    2    9    9 o 100.4867 1.182097   212.3952   344.6   100.9823 2.375700          ?        ? 
1 1 1    2    9   10 o 148.7207 1.506431   150.4167   161.1   221.2107 4.480750          ?        ? 
1 1 1    2    9   11 o 118.3557 1.346638   120.4202   257.2   140.1061 3.187647          ?        ? 
1 1 1    2    9   12 o 192.4848 1.726356   174.9086   348.4   370.6693 6.645944          ?        ? 
1 1 1    2    9   13 o 94.12661 1.150150   111.6418   265.5   88.62261 2.165194          ?        ? 
1 1 1    2    9   14 o 31.63479 1.425906   23.93858    21.3   10.01402 0.9021643          ?        ? 
1 1 1    2    9   15 o 129.5204 1.253776   169.3231   242.9   167.8627 3.247792          ?        ? 
1 1 1    2    9   16 o 156.1663 1.299813   176.4987   263.2   244.0956 4.059740          ?        ? 
1 1 1    2    9   17 o 97.37097 1.065501   91.17161   228.6   94.87762 2.074978          ?        ? 
1 1 1    2    9   18 o 10.39473 3.579063   9.362192    54.3  0.9923807 0.9021643          ?        ? 
1 1 1    2    9   19 o 20.29754 2.444584   36.32975   186.5   4.149956 0.9923807          ?        ? 
1 1 1    2    9   20 o 48.19133 1.310433   55.56475   139.8   23.30591 1.263030          ?        ? 
1 1 1    2    9   21 o 77.78271 1.179183   77.15237   330.5   60.74573 1.834401          ?        ? 
1 1 1    2    9   22 o 18.96313 2.854480   27.76172   342.0   3.728946 1.082597          ?        ? 
1 1 1    2    9   23 o 13.74061 4.264060   26.61128   257.7   2.135122 1.293102          ?        ? 
1 1 1    2    9   24 o 15.72077 3.928426   25.69941   209.6   2.916998 1.232958          ?        ? 
1 1 1    2   10    0 o 38.74495 0.8936365   130.8578    -0.0   15.03607 0.6916593   15.03607 0.6916593 
1 1 1    2   10    1 o 115.7550 0.9612277   96.06269   159.2   134.0015 2.225339          ?        ? 
1 1 1    2   10    2 o 35.70743 0.5895272   236.6269   119.0   12.75059 0.4210100          ?        ? 
1 1 1    2   10    3 f 170.0464 1.308666   66.15532   192.4   289.2038 4.450677          ?        ? 
1 1 1    2   10    4 o 222.7232 1.593239   285.9756   344.7   496.1603 7.097026          ?        ? 
1 1 1    2   10    5 o 443.0736 3.098341   499.4956   225.2   1964.463 27.45587          ?        ? 
1 1 1    2   10    6 o 329.3251 2.634422   405.1211    64.6   1084.913 17.35163          ?        ? 
1 1 1    2   10    7 o 495.1083 3.695939   532.5788    71.6   2452.474 36.59780          ?        ? 
1 1 1    2   10    8 o 602.0458 5.741744   602.2026    29.7   3629.678 69.13586          ?        ? 
1 1 1    2   10    9 o 86.16453 1.134277   129.2451   117.9   74.24812 1.954689          ?        ? 
1 1 1    2   10   10 o 110.6659 1.277169   192.8659   188.2   122.4838 2.826782          ?        ? 
1 1 1    2   10   11 o 58.70052 1.203900   69.45619   159.7   34.46268 1.413391          ?        ? 
1 1 1    2   10   12 o 110.1779 1.392002   170.0365    67.4   121.4313 3.067359          ?        ? 
1 1 1    2   10   13 o 86.83250 1.108236   112.5795    89.7   75.42094 1.924617          ?        ? 
1 1 1    2   10   14 o 55.01899 1.093155   69.69736   242.0   30.28265 1.202886          ?        ? 
1 1 1    2   10   15 o 133.9041 1.223959   150.9085   309.0   179.4104 3.277864          ?        ? 
1 1 1    2   10   16 o 113.0725 1.170200   126.7400   311.2   127.9570 2.646349          ?        ? 
1 1 1    2   10   17 f 69.07899 1.066558   49.49143    97.1   47.75457 1.473535          ?        ? 
1 1 1    2   10   18 o 44.07679 1.296308   40.09790   356.1   19.45668 1.142741          ?        ? 
1 1 1    2   10   19 o 78.13560 1.077639   77.55681   134.6   61.13667 1.684040          ?        ? 
1 1 1    2   10   20 o 20.09692 2.394169   28.45643   321.8   4.089812 0.9623086          ?        ? 
1 1 1    2   10   21 o 38.27704 1.610571   50.33280   186.1   14.76542 1.232958          ?        ? 
1 1 1    2   10   22 o 11.79433 3.976720   20.07192    87.4   1.443463 1.112669          ?        ? 
1 1 1    2   10   23 o 27.76799 2.436702   25.02775    90.3   7.999191 1.353247          ?        ? 
1 1 1    2   10   24 o 34.33655 2.058144   42.51454     4.1   12.26943 1.413391          ?        ? 
1 1 1    2   11    0 o 235.4423 2.408204   124.2209   180.0   554.6506 11.33720   554.6506 11.33720 
1 1 1    2   11    1 o 124.5255 1.062573   76.23803   161.0   155.0820 2.646349          ?        ? 
1 1 1    2   11    2 o 207.6480 1.484433   206.5693   171.5   431.2646 6.164790          ?        ? 
1 1 1    2   11    3 o 128.8809 1.049998   266.9139   190.1   166.1185 2.706493          ?        ? 
1 1 1    2   11    4 o 119.2982 1.020906   176.4388    94.0   142.3315 2.435844          ?        ? 
1 1 1    2   11    5 o 272.4669 1.870770   356.0674   282.9   742.5414 10.19446          ?        ? 
1 1 1    2   11    6 o 359.1613 2.830033   477.8580    20.6   1290.366 20.32877          ?        ? 
1 1 1    2   11    7 o 196.3451 1.723046   202.8242   105.5   385.5550 6.766232          ?        ? 
1 1 1    2   11    8 o 62.85952 0.9568048   152.9838   240.2   39.51480 1.202886          ?        ? 
1 1 1    2   11    9 o 107.6799 1.145022   98.27848    99.0   115.9582 2.465916          ?        ? 
1 1 1    2   11   10 o 94.56339 1.272042   160.4983    53.4   89.43456 2.405771          ?        ? 
1 1 1    2   11   11 o 96.79303 1.242740   98.64116   274.9   93.70480 2.405771          ?        ? 
1 1 1    2   11   12 o 137.7226 1.528471   175.4571   323.7   189.7552 4.210100          ?        ? 
1 1 1    2   11   13 o 147.1197 1.584147   164.1312   110.4   216.5796 4.661182          ?        ? 
1 1 1    2   11   14 o 58.79684 1.048490   73.40709   114.5   34.58297 1.232958          ?        ? 
1 1 1    2   11   15 f 9.041578 3.544588   36.23756   329.9  0.4811543 0.9322364          ?        ? 
1 1 1    2   11   16 o 48.72128 1.172733   61.57894   279.1   23.75699 1.142741          ?        ? 
1 1 1    2   11   17 o 118.1557 1.221662   128.3092   311.1   139.7453 2.886926          ?        ? 
1 1 1    2   11   18 f 27.86385 1.834730   13.29275   319.9   7.788685 1.022453          ?        ? 
1 1 1    2   11   19 o 78.83813 1.087108   87.64118     3.7   62.24934 1.714112          ?        ? 
1 1 1    2   11   20 o 40.84710 1.325182   49.64027   270.6   16.75019 1.082597          ?        ? 
1 1 1    2   11   21 o 56.72903 1.192729   49.67735    51.1   32.32756 1.353247          ?        ? 
1 1 1    2   11   22 o 20.30772 2.887606   14.19685   212.6   4.300317 1.172814          ?        ? 
1 1 1    2   11   23 o 12.38235 4.082782   6.650467   177.6   1.684040 1.172814          ?        ? 
1 1 1    2   11   24 o 9.736149 4.188076   18.69910   304.9  0.4210100 1.473535          ?        ? 
1 1 1    2   12    0 o 102.6184 1.392553   132.8811   180.0   105.3728 2.856854   105.3728 2.856854 
1 1 1    2   12    1 o 209.9584 1.539713   324.4697   124.9   440.9178 6.465511          ?        ? 
1 1 1    2   12    2 o 99.52463 0.8611497   166.0521   337.2   99.05764 1.714112          ?        ? 
1 1 1    2   12    3 o 187.9070 1.328310   289.5949   204.5   353.1372 4.991976          ?        ? 
1 1 1    2   12    4 o 135.5896 1.131119   208.2161   173.0   183.8611 3.067359          ?        ? 
1 1 1    2   12    5 o 407.5497 2.660045   609.6919   268.7   1661.516 21.68202          ?        ? 
1 1 1    2   12    6 o 413.5323 2.919715   439.2436   266.0   1710.594 24.14793          ?        ? 
1 1 1    2   12    7 o 117.2012 1.231611   48.63765   224.3   137.3696 2.886926          ?        ? 
1 1 1    2   12    8 f 177.9644 1.579948   216.7811   342.7   316.7499 5.623491          ?        ? 
1 1 1    2   12    9 o 317.8857 2.506913   275.0746   261.0   1010.905 15.93824          ?        ? 
1 1 1    2   12   10 o 323.3171 2.571762   348.1886   102.9   1045.999 16.62990          ?        ? 
1 1 1    2   12   11 o 55.15995 1.335693   51.21271    18.6   30.43301 1.473535          ?        ? 
1 1 1    2   12   12 o 105.9904 1.390254   157.6987    60.8   112.3796 2.947070          ?        ? 
1 1 1    2   12   13 o 77.77080 1.198697   68.52341    63.5   60.50515 1.864473          ?        ? 
1 1 1    2   12   14 o 175.8552 1.573247   201.3638    54.1   309.5326 5.533275          ?        ? 
1 1 1    2   12   15 o 206.2015 1.830275   251.1317   123.7   425.8817 7.548109          ?        ? 
1 1 1    2   12   16 o 54.76472 1.098230   70.75732    52.3   30.01200 1.202886          ?        ? 
1 1 1    2   12   17 o 62.57043 1.129440   63.75652    75.4   39.18401 1.413391          ?        ? 
1 1 1    2   12   18 o 46.62510 1.257706   53.88074    54.1   21.77223 1.172814          ?        ? 
1 1 1    2   12   19 o 44.79898 1.275410   48.67032   109.4   20.11827 1.142741          ?        ? 
1 1 1    2   12   20 o 22.94153 2.228389   22.94156    81.3   5.322770 1.022453          ?        ? 
1 1 1    2   12   21 o 47.82734 1.288968   54.67847   354.1   23.00519 1.232958          ?        ? 
1 1 1    2   12   22 o 39.17926 1.573483   44.55199    82.2   15.54730 1.232958          ?        ? 
1 1 1    2   12   23 o 11.78491 4.125479   10.36385   324.3   1.473535 1.202886          ?        ? 
1 1 1    2   12   24 o 28.00572 2.469707   20.89512   187.0   8.390128 1.383319          ?        ? 
1 1 1    2   13    0 f 137.0473 1.646250   115.4338   180.0   187.9208 4.510822   187.9208 4.510822 
1 1 1    2   13    1 o 165.0425 1.257238   125.0982   338.1   272.4236 4.149956          ?        ? 
1 1 1    2   13    2 o 120.8632 1.032568   185.5462   185.0   146.0905 2.495988          ?        ? 
1 1 1    2   13    3 o 286.2718 1.864594   266.3860   234.8   819.7065 10.67561          ?        ? 
1 1 1    2   13    4 o 147.8131 1.220682   98.70966   138.7   218.5042 3.608657          ?        ? 
1 1 1    2   13    5 o 326.2180 2.217030   401.9612    29.5   1064.373 14.46470          ?        ? 
1 1 1    2   13    6 o 800.3801 5.290184   831.0431   349.0   6412.464 84.68316          ?        ? 
1 1 1    2   13    7 o 571.7408 4.247249   690.8302   312.2   3271.458 48.56651          ?        ? 
1 1 1    2   13    8 o 212.7214 1.858998   289.7994    31.5   452.5858 7.908974          ?        ? 
1 1 1    2   13    9 o 81.48212 1.125646   151.6818   133.0   66.39930 1.834401          ?        ? 
1 1 1    2   13   10 o 57.19603 1.182990   94.20496    57.8   32.71849 1.353247          ?        ? 
1 1 1    2   13   11 o 97.78046 1.153304   113.7338   136.2   95.62942 2.255411          ?        ? 
1 1 1    2   13   12 o 142.3139 1.521422   138.7967   238.3   202.6261 4.330389          ?        ? 
1 1 1    2   13   13 o 112.5268 1.389670   140.7803   191.8   126.6939 3.127503          ?        ? 
1 1 1    2   13   14 o 85.57783 1.265044   87.71963   259.7   73.28581 2.165194          ?        ? 
1 1 1    2   13   15 o 105.5776 1.167822   138.8981   113.6   111.5376 2.465916          ?        ? 
1 1 1    2   13   16 o 35.08774 1.628406   30.32538   288.9   12.32958 1.142741          ?        ? 
1 1 1    2   13   17 o 186.1233 1.534925   209.5605    70.6   347.0025 5.713707          ?        ? 
1 1 1    2   13   18 o 115.9960 1.218482   113.8080   314.1   134.7533 2.826782          ?        ? 
1 1 1    2   13   19 o 77.45557 1.145338   83.03977    72.9   60.11422 1.774257          ?        ? 
1 1 1    2   13   20 o 28.95284 1.817654   25.23734    93.3   8.450273 1.052525          ?        ? 
1 1 1    2   13   21 o 24.97656 2.167226   28.47926    18.6   6.345222 1.082597          ?        ? 
1 1 1    2   13   22 o 32.63597 1.888956   19.03521    41.0   10.85604 1.232958          ?        ? 
1 1 1    2   13   23 o 9.982915 3.880849   11.37140    91.9  0.8420200 1.112669          ?        ? 
1 1 1    2   13   24 o 6.543364 3.163533   8.563084   164.4  -1.593824 1.263030          ?        ? 
1 1 1    2   14    0 o 191.7198 2.094571   346.5873     0.0   367.7523 8.029263   367.7523 8.029263 
1 1 1    2   14    1 o 209.0523 1.532001   339.3388   267.4   437.0986 6.405366          ?        ? 
1 1 1    2   14    2 o 303.0812 2.039000   299.8858     2.4   918.8243 12.35965          ?        ? 
1 1 1    2   14    3 f 220.1810 1.502372   188.9625   345.3   484.8532 6.615872          ?        ? 
1 1 1    2   14    4 o 406.9288 2.693665   436.3226   279.5   1656.374 21.92259          ?        ? 
1 1 1    2   14    5 o 130.5419 1.082710   103.8094   301.2   170.4189 2.826782          ?        ? 
1 1 1    2   14    6 o 40.55692 1.112220   84.75177   141.0   16.44946 0.9021643          ?        ? 
1 1 1    2   14    7 o 122.2001 1.193534   82.91835   128.7   149.3383 2.916998          ?        ? 
1 1 1    2   14    8 o 95.86026 1.254833   144.0014   260.9   91.90047 2.405771          ?        ? 
1 1 1    2   14    9 o 243.1800 2.046608   251.7833   103.5   591.5792 9.953879          ?        ? 
1 1 1    2   14   10 f 180.2335 1.585085   218.5321     4.5   324.9295 5.713707          ?        ? 
1 1 1    2   14   11 o 327.5854 2.625463   349.8057   265.2   1074.418 17.20127          ?        ? 
1 1 1    2   14   12 o 140.6021 1.411616   154.9091   331.1   197.7845 3.969523          ?        ? 
1 1 1    2   14   13 o 20.20691 2.232317   19.31077   344.1   4.089812 0.9021643          ?        ? 
1 1 1    2   14   14 o 95.95604 1.331929   102.1623   317.2   92.14105 2.556132          ?        ? 
1 1 1    2   14   15 o 10.18866 3.979519   20.81728   212.7  0.6315150 1.172814          ?        ? 
1 1 1    2   14   16 o 85.97394 1.189259   94.86810   232.0   73.97748 2.044906          ?        ? 
1 1 1    2   14   17 o 100.3137 1.199124   116.8991   237.8   100.7417 2.405771          ?        ? 
1 1 1    2   14   18 o 67.57804 1.156997   71.08253   217.3   45.73973 1.563751          ?        ? 
1 1 1    2   14   19 o 8.117447 3.516187   12.84483   115.3 -0.1202886 1.052525          ?        ? 
1 1 1    2   14   20 o 14.30339 3.494156   24.16955   238.4   2.195267 0.9923807          ?        ? 
1 1 1    2   14   21 o 39.85894 1.546652   36.26545   128.7   16.02845 1.232958          ?        ? 
1 1 1    2   14   22 o 27.94931 2.151906   25.16207   254.3   8.029263 1.202886          ?        ? 
1 1 1    2   14   23 o 7.952595 3.563166   7.746562   290.6 -0.2706493 1.172814          ?        ? 
1 1 1    2   14   24 o 19.82900 3.184806   17.87534   129.1   4.420605 1.263030          ?        ? 
1 1 1    2   15    0 o 188.9684 2.045468   274.8011     0.0   357.2571 7.728541   357.2571 7.728541 
1 1 1    2   15    1 o 349.7568 2.291371   473.0428   145.6   1223.636 16.02845          ?        ? 
1 1 1    2   15    2 o 339.9231 2.202841   397.2104   358.1   1155.733 14.97593          ?        ? 
1 1 1    2   15    3 o 338.0237 2.161840   316.0154   105.3   1142.802 14.61506          ?        ? 
1 1 1    2   15    4 o 185.3112 1.346917   185.1322   229.7   343.4239 4.991976          ?        ? 
1 1 1    2   15    5 o 363.6265 2.439669   359.3105   244.2   1322.543 17.74257          ?        ? 
1 1 1    2   15    6 o 540.4911 3.438462   588.0793   312.7   2922.832 37.16917          ?        ? 
1 1 1    2   15    7 o 279.2484 2.126869   282.1260   339.5   779.9812 11.87850          ?        ? 
1 1 1    2   15    8 o 120.1011 1.176834   193.1730   318.1   144.2561 2.826782          ?        ? 
1 1 1    2   15    9 o 191.5139 1.703703   279.0257   331.9   366.8802 6.525656          ?        ? 
1 1 1    2   15   10 o 244.0018 2.089012   270.0313   165.3   595.6991 10.19446          ?        ? 
1 1 1    2   15   11 o 80.19314 1.124990   96.64108   150.4   64.32432 1.804329          ?        ? 
1 1 1    2   15   12 o 26.46065 1.704728   22.34769    81.4   7.006810 0.9021643          ?        ? 
1 1 1    2   15   13 o 106.8866 1.237924   140.6447   108.9   114.3042 2.646349          ?        ? 
1 1 1    2   15   14 o 97.94523 1.182066   103.8171   121.7   95.99029 2.315555          ?        ? 
1 1 1    2   15   15 o 74.99302 1.283198   80.86056   104.0   56.29506 1.924617          ?        ? 
1 1 1    2   15   16 o 131.9358 1.413167   135.2567   191.9   174.2981 3.728946          ?        ? 
1 1 1    2   15   17 o 8.405382 3.652666   14.95588   335.1 -0.1804329 1.142741          ?        ? 
1 1 1    2   15   18 o 64.15844 1.148356   53.90982    69.7   41.22891 1.473535          ?        ? 
1 1 1    2   15   19 o 68.42827 1.120648   73.22903   251.0   46.94262 1.533679          ?        ? 
1 1 1    2   15   20 o 13.69213 3.661523   4.225171   276.0   2.014834 1.022453          ?        ? 
1 1 1    2   15   21 o 34.53299 1.654565   41.13498   234.4   12.05893 1.142741          ?        ? 
1 1 1    2   15   22 o 39.78223 1.625226   39.66106   175.0   16.08860 1.293102          ?        ? 
1 1 1    2   15   23 o 44.55836 1.653489   34.47946    88.6   20.32877 1.473535          ?        ? 
1 1 1    2   15   24 o 15.41848 4.045254   17.09242    76.5   2.977142 1.263030          ?        ? 
1 1 1    2   16    0 o 43.48355 1.108115   81.86169     0.0   18.94545 0.9623086   18.94545 0.9623086 
1 1 1    2   16    1 f 228.8871 1.655441   443.4607    67.6   523.9470 7.578181          ?        ? 
1 1 1    2   16    2 o 379.5127 2.456404   416.2751   188.4   1440.606 18.64473          ?        ? 
1 1 1    2   16    3 o 159.5457 1.196887   213.6540    75.9   254.5607 3.819162          ?        ? 
1 1 1    2   16    4 o 316.3684 2.010396   278.5695    74.8   1001.042 12.72052          ?        ? 
1 1 1    2   16    5 o 58.83176 0.9200789   67.70538    26.5   34.61304 1.082597          ?        ? 
1 1 1    2   16    6 o 315.0278 2.195550   269.9286    66.0   992.6514 13.83319          ?        ? 
1 1 1    2   16    7 o 283.5790 2.179225   323.6942   326.1   804.3998 12.35965          ?        ? 
1 1 1    2   16    8 o 272.1591 2.088350   292.8846   316.6   740.9777 11.36727          ?        ? 
1 1 1    2   16    9 o 72.16565 1.062611   47.69423   218.7   52.08495 1.533679          ?        ? 
1 1 1    2   16   10 o 93.81072 1.089911   64.77252   293.8   88.02117 2.044906          ?        ? 
1 1 1    2   16   11 o 120.4360 1.310894   159.7095   240.4   145.0981 3.157575          ?        ? 
1 1 1    2   16   12 o 149.3419 1.480028   194.8378   244.5   223.1654 4.420605          ?        ? 
1 1 1    2   16   13 o 185.3848 1.727587   192.4753   332.3   344.0855 6.405366          ?        ? 
1 1 1    2   16   14 o 99.92890 1.218789   95.84730   153.5   99.92973 2.435844          ?        ? 
1 1 1    2   16   15 o 75.99413 1.206936   73.46124   118.4   57.79866 1.834401          ?        ? 
1 1 1    2   16   16 o 61.98904 1.188545   75.72865   173.3   38.46227 1.473535          ?        ? 
1 1 1    2   16   17 o 46.29831 1.331537   43.30675   317.1   21.47151 1.232958          ?        ? 
1 1 1    2   16   18 o 65.35032 1.265463   65.36944   144.1   42.79266 1.653968          ?        ? 
1 1 1    2   16   19 o 10.82572 3.802186   18.86975   329.4   1.082597 1.022453          ?        ? 
1 1 1    2   16   20 o 18.61471 2.827132   16.49336   132.3   3.548513 1.052525          ?        ? 
1 1 1    2   16   21 o 46.35712 1.362283   24.41683   205.8   21.68202 1.263030          ?        ? 
1 1 1    2   16   22 o 7.790812 3.459510   9.172161   171.4 -0.2405772 1.082597          ?        ? 
1 1 1    2   16   23 o 14.14216 4.046604   15.26505   322.9   2.375700 1.202886          ?        ? 
1 1 1    2   17    0 o 185.2284 2.029943   235.8709   180.0   343.2435 7.518036   343.2435 7.518036 
1 1 1    2   17    1 o 143.2698 1.196423   134.8771    41.5   205.2724 3.428224          ?        ? 
1 1 1    2   17    2 o 229.7204 1.655981   211.9308    79.4   527.7661 7.608253          ?        ? 
1 1 1    2   17    3 o 263.5090 1.786008   319.3189   330.1   694.4561 9.412581          ?        ? 
1 1 1    2   17    4 o 287.6291 1.902843   318.7974   276.3   827.4351 10.94626          ?        ? 
1 1 1    2   17    5 o 324.4997 2.261205   349.2224   336.4   1053.247 14.67521          ?        ? 
1 1 1    2   17    6 o 162.3345 1.352310   192.8347   175.9   263.5523 4.390533          ?        ? 
1 1 1    2   17    7 o 386.4187 2.797726   440.8360   178.4   1494.014 21.62187          ?        ? 
1 1 1    2   17    8 o 393.4619 2.804967   389.9164   284.8   1549.317 22.07295          ?        ? 
1 1 1    2   17    9 o 126.4481 1.296130   80.66504   329.7   159.9237 3.277864          ?        ? 
1 1 1    2   17   10 o 171.0830 1.494089   224.1048   213.9   292.8125 5.112265          ?        ? 
1 1 1    2   17   11 o 139.5234 1.282432   157.6673   181.9   194.7472 3.578585          ?        ? 
1 1 1    2   17   12 o 95.21357 1.184396   51.33810   158.0   90.69759 2.255411          ?        ? 
1 1 1    2   17   13 o 159.9671 1.569713   157.3443    44.3   256.1545 5.022048          ?        ? 
1 1 1    2   17   14 o 140.3016 1.414640   158.3746    86.6   197.0327 3.969523          ?        ? 
1 1 1    2   17   15 o 81.54440 1.216982   84.08919   120.6   66.54966 1.984761          ?        ? 
1 1 1    2   17   16 o 67.34904 1.250233   46.44622   261.8   45.40894 1.684040          ?        ? 
1 1 1    2   17   17 o 54.23594 1.386172   46.20553   248.4   29.47070 1.503607          ?        ? 
1 1 1    2   17   18 o 39.02167 1.464240   24.24743   184.6   15.27665 1.142741          ?        ? 
1 1 1    2   17   19 o 23.65918 2.097242   24.86299   209.5   5.653563 0.9923807          ?        ? 
1 1 1    2   17   20 o 18.08388 2.494388   24.03978   133.9   3.338008 0.9021643          ?        ? 
1 1 1    2   17   21 o 44.75641 1.310219   40.92586    73.4   20.20848 1.172814          ?        ? 
1 1 1    2   17   22 o 9.168468 3.883076   9.042621   188.1  0.2706493 1.232958          ?        ? 
1 1 1    2   17   23 o 26.10841 2.418818   29.66329   324.2   7.217315 1.263030          ?        ? 
1 1 1    2   18    0 o 111.9010 1.384480   49.58731   180.0   125.2806 3.097431   125.2806 3.097431 
1 1 1    2   18    1 o 341.5612 2.311135   355.6146    32.5   1166.889 15.78788          ?        ? 
1 1 1    2   18    2 o 199.7774 1.490230   222.4369   161.2   399.1476 5.954284          ?        ? 
1 1 1    2   18    3 o 248.7395 1.722798   247.4386   214.6   618.7945 8.570561          ?        ? 
1 1 1    2   18    4 o 32.53429 1.109186   26.79835     1.3   10.58539 0.7217315          ?        ? 
1 1 1    2   18    5 o 242.6522 1.778411   209.0906   238.9   588.9028 8.630706          ?        ? 
1 1 1    2   18    6 o 81.13189 0.9822425   143.2227   160.2   65.82793 1.593824          ?        ? 
1 1 1    2   18    7 o 176.6270 1.430167   208.0801   142.0   312.0286 5.052120          ?        ? 
1 1 1    2   18    8 o 113.8381 1.201955   163.2468   155.5   129.6109 2.736565          ?        ? 
1 1 1    2   18    9 f 218.5863 1.747210   210.9107   121.6   478.0268 7.638325          ?        ? 
1 1 1    2   18   10 o 42.36487 1.242214   49.70360    66.2   17.95307 1.052525          ?        ? 
1 1 1    2   18   11 o 138.2436 1.326934   140.5469    17.5   191.1987 3.668802          ?        ? 
1 1 1    2   18   12 o 22.19155 2.100431   15.73838   309.6   4.931832 0.9322364          ?        ? 
1 1 1    2   18   13 o 46.89985 1.346518   41.30835    73.8   22.01281 1.263030          ?        ? 
1 1 1    2   18   14 o 67.99863 1.260402   73.34125    57.2   46.28103 1.714112          ?        ? 
1 1 1    2   18   15 o 116.7321 1.429773   117.8727   205.2   136.4373 3.338008          ?        ? 
1 1 1    2   18   16 o 78.35142 1.266577   60.72315   231.1   61.46746 1.984761          ?        ? 
1 1 1    2   18   17 o 50.59058 1.396891   50.30645   154.6   25.65154 1.413391          ?        ? 
1 1 1    2   18   18 o 61.99635 1.212658   57.34960   184.5   38.52242 1.503607          ?        ? 
1 1 1    2   18   19 o 30.31912 1.735745   34.39133   312.6   9.262220 1.052525          ?        ? 
1 1 1    2   18   20 o 13.63502 3.508992   18.40083   295.0   2.014834 0.9623086          ?        ? 
1 1 1    2   18   21 o 9.125973 3.666348   10.96170   136.1  0.5112265 1.022453          ?        ? 
1 1 1    2   18   22 o 27.66899 2.010679   19.69203   282.2   7.878902 1.112669          ?        ? 
1 1 1    2   18   23 o 29.00885 2.021476   25.77310   295.2   8.811138 1.172814          ?        ? 
1 1 1    2   19    0 o 222.2478 2.395595   147.6346     0.0   494.1756 10.64554   494.1756 10.64554 
1 1 1    2   19    1 o 242.5889 1.729289   224.7836   327.9   588.5720 8.390128          ?        ? 
1 1 1    2   19    2 o 98.63023 0.9756731   127.1638   307.1   97.28339 1.924617          ?        ? 
1 1 1    2   19    3 o 490.2113 3.008986   504.1348   204.9   2404.118 29.50077          ?        ? 
1 1 1    2   19    4 o 295.8293 1.977165   279.6511    31.2   875.3400 11.69806          ?        ? 
1 1 1    2   19    5 o 313.2076 2.064290   310.5920   224.9   981.2541 12.93102          ?        ? 
1 1 1    2   19    6 o 92.78391 1.053356   144.9861   184.2   86.09655 1.954689          ?        ? 
1 1 1    2   19    7 o 43.97033 1.128466   75.11742    59.2   19.33639 0.9923807          ?        ? 
1 1 1    2   19    8 o 175.0511 1.571884   187.2962    21.9   306.5254 5.503202          ?        ? 
1 1 1    2   19    9 o 70.96431 1.122976   77.06048   292.4   50.37084 1.593824          ?        ? 
1 1 1    2   19   10 o 127.1006 1.265816   146.0196   234.0   161.6077 3.217719          ?        ? 
1 1 1    2   19   11 o 78.57817 1.090705   60.98336    33.4   61.76818 1.714112          ?        ? 
1 1 1    2   19   12 o 39.98326 1.316207   64.98156    89.8   15.99838 1.052525          ?        ? 
1 1 1    2   19   13 o 32.83901 1.510978   35.13388   181.5   10.79590 0.9923807          ?        ? 
1 1 1    2   19   14 o 102.6588 1.113145   95.34924     2.9   105.4630 2.285483          ?        ? 
1 1 1    2   19   15 o 91.38743 1.233983   94.25379   116.8   83.60056 2.255411          ?        ? 
1 1 1    2   19   16 o 109.6675 1.247665   104.5031   113.4   120.4389 2.736565          ?        ? 
1 1 1    2   19   17 o 34.57302 1.783121   51.21187   173.4   11.99879 1.232958          ?        ? 
1 1 1    2   19   18 o 79.30467 1.270312   75.75948   257.3   63.09136 2.014834          ?        ? 
1 1 1    2   19   19 o 51.16996 1.322306   58.42024   251.3   26.31313 1.353247          ?        ? 
1 1 1    2   19   20 o 31.96044 1.834790   34.66095   331.6   10.34482 1.172814          ?        ? 
1 1 1    2   19   21 o 20.05270 2.549415   18.79494   284.8   4.180028 1.022453          ?        ? 
1 1 1    2   19   22 o 18.82714 2.715370   14.26443   183.1   3.759018 1.022453          ?        ? 
1 1 1    2   19   23 o 5.576596 2.741174   9.558738   111.2  -1.834401 1.052525          ?        ? 
1 1 1    2   20    0 o 57.96264 1.324527   3.379638   180.0   33.65073 1.533679   33.65073 1.533679 
1 1 1    2   20    1 o 220.1387 1.598284   238.4222   173.9   484.6727 7.036882          ?        ? 
1 1 1    2   20    2 o 113.6453 1.031995   167.0868   198.0   129.1599 2.345627          ?        ? 
1 1 1    2   20    3 o 734.6481 4.271472   681.6345    62.8   5402.852 62.76057          ?        ? 
1 1 1    2   20    4 o 145.8359 1.185681   96.08309   208.4   212.7003 3.458297          ?        ? 
1 1 1    2   20    5 o 326.1256 2.148500   298.5167   134.4   1063.983 14.01362          ?        ? 
1 1 1    2   20    6 o 89.23139 1.044741   129.6910   266.4   79.63103 1.864473          ?        ? 
1 1 1    2   20    7 o 30.77378 1.514661   34.41128   265.1   9.472726 0.9322364          ?        ? 
1 1 1    2   20    8 f 146.1478 1.409492   98.24570   112.7   213.6626 4.119884          ?        ? 
1 1 1    2   20    9 o 68.66051 1.073059   92.12382   149.1   47.15312 1.473535          ?        ? 
1 1 1    2   20   10 o 184.5525 1.564285   200.3119   336.1   340.8076 5.773852          ?        ? 
1 1 1    2   20   11 o 112.2920 1.191723   99.38972    21.7   126.1526 2.676421          ?        ? 
1 1 1    2   20   12 o 76.93044 1.114066   95.68797    98.6   59.21205 1.714112          ?        ? 
1 1 1    2   20   13 o 95.99118 1.127809   89.66946   175.5   92.20119 2.165194          ?        ? 
1 1 1    2   20   14 o 58.55294 1.206934   78.39895   259.2   34.31232 1.413391          ?        ? 
1 1 1    2   20   15 o 100.1402 1.201202   101.2895    20.8   100.3808 2.405771          ?        ? 
1 1 1    2   20   16 o 52.15469 1.297339   67.15302   218.1   27.24536 1.353247          ?        ? 
1 1 1    2   20   17 o 44.95464 1.471677   51.56552   166.8   20.26863 1.323174          ?        ? 
1 1 1    2   20   18 o 50.77031 1.421562   52.52025   255.3   25.89212 1.443463          ?        ? 
1 1 1    2   20   19 o 13.38720 3.698487   5.241915    15.3   1.924617 1.022453          ?        ? 
1 1 1    2   20   20 o 28.69166 2.043823   34.66918   308.6   8.390128 1.172814          ?        ? 
1 1 1    2   20   21 o 41.06979 1.427830   43.81243   320.0   17.08098 1.172814          ?        ? 
1 1 1    2   20   22 o 6.569871 3.079912   5.272935    27.0 -0.8420200 1.022453          ?        ? 
1 1 1    2   20   23 o 6.623692 3.108680   8.709499   354.3 -0.7818757 1.052525          ?        ? 
1 1 1    2   21    0 o 240.0287 2.456176   220.8908   180.0   576.4229 11.78828   576.4229 11.78828 
1 1 1    2   21    1 o 347.3323 2.329011   306.7345   176.9   1206.795 16.17881          ?        ? 
1 1 1    2   21    2 o 253.9939 1.775957   262.1879   147.3   645.2580 9.021644          ?        ? 
1 1 1    2   21    3 o 195.3669 1.408428   226.3530     0.4   381.7358 5.503202          ?        ? 
1 1 1    2   21    4 f 60.84064 0.9638407   51.39548    46.9   37.01881 1.172814          ?        ? 
1 1 1    2   21    5 o 245.8622 1.724613   233.5412    97.4   604.6606 8.480345          ?        ? 
1 1 1    2   21    6 o 193.6152 1.568724   175.9179    29.8   374.9696 6.074574          ?        ? 
1 1 1    2   21    7 o 226.2638 1.741088   220.1715    90.4   512.1888 7.878902          ?        ? 
1 1 1    2   21    8 o 81.31003 1.128029   94.33054    64.0   66.12865 1.834401          ?        ? 
1 1 1    2   21    9 o 59.05232 1.171265   37.83684    68.1   34.88369 1.383319          ?        ? 
1 1 1    2   21   10 o 147.8159 1.373242   180.5583   301.0   218.6245 4.059740          ?        ? 
1 1 1    2   21   11 o 35.13818 1.583277   42.81148   218.2   12.35965 1.112669          ?        ? 
1 1 1    2   21   12 o 107.8551 1.212866   120.0610   227.9   116.4093 2.616277          ?        ? 
1 1 1    2   21   13 o 73.97321 1.117951   77.41801   250.0   54.76138 1.653968          ?        ? 
1 1 1    2   21   14 o 51.44592 1.256759   49.14671   218.1   26.49356 1.293102          ?        ? 
1 1 1    2   21   15 o 152.9005 1.386580   146.5677   233.8   234.1417 4.240172          ?        ? 
1 1 1    2   21   16 o 81.19212 1.092629   81.64398   346.1   66.00835 1.774257          ?        ? 
1 1 1    2   21   17 o 20.56169 2.559432   36.01568   322.5   4.270245 1.052525          ?        ? 
1 1 1    2   21   18 o 20.50767 2.566175   21.55590   186.7   4.270245 1.052525          ?        ? 
1 1 1    2   21   19 o 48.95881 1.351314   58.68336   345.6   24.11786 1.323174          ?        ? 
1 1 1    2   21   20 o 8.175972 3.474149   9.587387   131.6  0.1202886 0.9923807          ?        ? 
1 1 1    2   21   21 o 27.56511 2.127352   18.12609   319.9   7.818758 1.172814          ?        ? 
1 1 1    2   21   22 f 19.64371 2.679038   16.84265    11.1   4.119884 1.052525          ?        ? 
1 1 1    2   22    0 o 131.0264 1.595640   113.3786   180.0   171.7721 4.180028   171.7721 4.180028 
1 1 1    2   22    1 o 75.24733 0.9791278   124.5143   227.8   56.62585 1.473535          ?        ? 
1 1 1    2   22    2 o 54.45093 0.9112616   15.90932    99.9   29.65113 0.9923807          ?        ? 
1 1 1    2   22    3 o 160.9544 1.251804   165.8175   319.1   259.1016 4.029667          ?        ? 
1 1 1    2   22    4 o 103.8542 1.042420   84.83809   275.0   107.8688 2.165194          ?        ? 
1 1 1    2   22    5 o 149.9877 1.213009   120.7988   353.3   224.9998 3.638730          ?        ? 
1 1 1    2   22    6 o 183.9601 1.487586   204.5132   308.3   338.5221 5.473131          ?        ? 
1 1 1    2   22    7 o 299.8454 2.136223   333.9346   215.9   899.8187 12.81073          ?        ? 
1 1 1    2   22    8 o 42.07724 1.393644   19.69591   354.3   17.71249 1.172814          ?        ? 
1 1 1    2   22    9 o 186.4664 1.612738   167.8998   152.7   347.9347 6.014429          ?        ? 
1 1 1    2   22   10 o 173.9061 1.573588   173.8187   104.5   302.6761 5.473131          ?        ? 
1 1 1    2   22   11 o 163.9315 1.467546   143.5418   147.5   268.9653 4.811543          ?        ? 
1 1 1    2   22   12 o 56.30579 1.228398   69.39544   313.7   31.72611 1.383319          ?        ? 
1 1 1    2   22   13 o 167.0817 1.457876   177.4768   341.5   279.4905 4.871688          ?        ? 
1 1 1    2   22   14 o 107.9522 1.211776   104.1611   165.4   116.6498 2.616277          ?        ? 
1 1 1    2   22   15 o 37.98176 1.702268   44.93565   252.3   14.46470 1.293102          ?        ? 
1 1 1    2   22   16 o 11.11876 3.911688   24.68577   112.4   1.112669 1.082597          ?        ? 
1 1 1    2   22   17 o 56.34127 1.334375   48.42204   176.9   31.84640 1.503607          ?        ? 
1 1 1    2   22   18 o 13.70458 3.660014   21.24424    79.5   2.014834 1.022453          ?        ? 
1 1 1    2   22   19 o 28.18755 1.973690   25.22702   246.0   8.059335 1.112669          ?        ? 
1 1 1    2   22   20 o 36.66602 1.435287   36.16211    27.2   13.59261 1.052525          ?        ? 
1 1 1    2   22   21 o 33.13155 1.633786   19.70757   308.1   11.18684 1.082597          ?        ? 
1 1 1    2   22   22 o 28.89782 1.821115   32.66619     6.2   8.660777 1.052525          ?        ? 
1 1 1    2   23    0 o 135.3704 1.588842   187.2779     0.0   183.3499 4.300317   183.3499 4.300317 
1 1 1    2   23    1 o 356.5051 2.366091   331.9802   248.1   1271.661 16.87047          ?        ? 
1 1 1    2   23    2 o 307.8334 2.071021   306.8467   332.2   948.0244 12.75059          ?        ? 
1 1 1    2   23    3 o 160.1670 1.229795   209.2923   160.7   256.5755 3.939451          ?        ? 
1 1 1    2   23    4 f 214.9198 1.511165   280.1378   190.8   462.0284 6.495584          ?        ? 
1 1 1    2   23    5 o 79.65182 0.9249852   88.38052   218.0   63.45222 1.473535          ?        ? 
1 1 1    2   23    6 o 327.2009 2.357421   294.8660   191.7   1071.681 15.42701          ?        ? 
1 1 1    2   23    7 o 114.1347 1.159310   118.6771    21.0   130.3026 2.646349          ?        ? 
1 1 1    2   23    8 o 121.9238 1.183906   122.7670   330.3   148.7068 2.886926          ?        ? 
1 1 1    2   23    9 o 60.20802 1.198730   39.92049    28.6   36.26701 1.443463          ?        ? 
1 1 1    2   23   10 o 89.26027 1.179164   87.44466    21.5   79.72126 2.105050          ?        ? 
1 1 1    2   23   11 o 177.5754 1.490268   171.0574   245.7   315.6673 5.292697          ?        ? 
1 1 1    2   23   12 o 93.23441 1.177283   85.77820   202.9   86.99871 2.195267          ?        ? 
1 1 1    2   23   13 o 162.9558 1.476333   156.0394   215.1   265.8979 4.811543          ?        ? 
1 1 1    2   23   14 o 61.47142 1.247473   56.54519   190.8   37.83076 1.533679          ?        ? 
1 1 1    2   23   15 f 50.09550 1.350667   37.91700   126.0   25.14031 1.353247          ?        ? 
1 1 1    2   23   16 o 36.09448 1.707959   48.40404   110.3   13.08138 1.232958          ?        ? 
1 1 1    2   23   17 o 26.14615 2.300312   30.26951   238.5   6.916593 1.202886          ?        ? 
1 1 1    2   23   18 f 58.00721 1.244210   53.37721   114.6   33.80109 1.443463          ?        ? 
1 1 1    2   23   19 o 40.60357 1.592350   40.15198    72.6   16.65997 1.293102          ?        ? 
1 1 1    2   23   20 o 37.70245 1.674997   29.32554   200.2   14.46470 1.263030          ?        ? 
1 1 1    2   23   21 o 18.97676 2.693961   17.52250   347.8   3.819162 1.022453          ?        ? 
1 1 1    2   23   22 o 13.20299 3.927388   15.35730   356.9   2.135122 1.112669          ?        ? 
1 1 1    2   24    0 f 255.5263 2.589713   254.1160   180.0   653.3775 13.23174   653.3775 13.23174 
1 1 1    2   24    1 o 66.39362 0.9738153   129.2520   279.6   44.08577 1.293102          ?        ? 
1 1 1    2   24    2 o 272.0916 1.878876   277.7827   122.8   740.6469 10.22453          ?        ? 
1 1 1    2   24    3 o 172.3140 1.335074   165.3113   121.1   296.9925 4.601038          ?        ? 
1 1 1    2   24    4 o 58.77720 0.9720960   116.9445   145.8   34.55289 1.142741          ?        ? 
1 1 1    2   24    5 o 139.2215 1.177212   120.3050   299.0   193.8751 3.277864          ?        ? 
1 1 1    2   24    6 f 29.01104 1.503035   6.868454   197.9   8.420200 0.8720922          ?        ? 
1 1 1    2   24    7 o 79.55157 1.039557   91.23802    49.4   63.30186 1.653968          ?        ? 
1 1 1    2   24    8 o 54.46958 1.131786   40.06704   104.5   29.68121 1.232958          ?        ? 
1 1 1    2   24    9 o 206.8554 1.766338   216.8486   348.4   428.3777 7.307531          ?        ? 
1 1 1    2   24   10 o 82.58234 1.128857   55.20743   147.6   68.23370 1.864473          ?        ? 
1 1 1    2   24   11 o 32.96890 1.778667   35.05957    50.9   10.88612 1.172814          ?        ? 
1 1 1    2   24   12 o 111.4422 1.173827   113.1447    48.6   124.2882 2.616277          ?        ? 
1 1 1    2   24   13 o 110.7228 1.262933   102.2314   158.0   122.7244 2.796710          ?        ? 
1 1 1    2   24   14 o 79.49298 1.210558   70.45514    21.5   63.27179 1.924617          ?        ? 
1 1 1    2   24   15 o 95.63436 1.242074   103.9077   263.7   91.62983 2.375700          ?        ? 
1 1 1    2   24   16 o 70.14416 1.243286   68.40956   220.6   49.31832 1.744184          ?        ? 
1 1 1    2   24   17 o 68.36163 1.165730   65.18636   295.5   46.88247 1.593824          ?        ? 
1 1 1    2   24   18 o 59.43626 1.264891   58.83391   328.1   35.51520 1.503607          ?        ? 
1 1 1    2   24   19 o 15.65569 3.622565   21.05029   288.1   2.706493 1.112669          ?        ? 
1 1 1    2   24   20 o 30.39123 2.028477   28.58740   181.7   9.472726 1.232958          ?        ? 
1 1 1    2   24   21 o 22.66159 2.322266   24.81026   222.6   5.382914 1.052525          ?        ? 
1 1 1    2   24   22 o 12.05423 3.863140   9.140634    45.8   1.774257 1.052525          ?        ? 
1 1 1    2   25    0 o 279.7611 2.714753   274.0276   180.0   783.3192 15.18643   783.3192 15.18643 
1 1 1    2   25    1 o 65.41182 0.9194714   75.20248    72.3   42.79266 1.202886          ?        ? 
1 1 1    2   25    2 o 141.7587 1.187963   138.1630    68.5   201.0022 3.368080          ?        ? 
1 1 1    2   25    3 o 313.7101 2.108913   332.4101    11.2   984.9229 13.23174          ?        ? 
1 1 1    2   25    4 o 138.5839 1.139229   83.48991    14.7   192.1009 3.157575          ?        ? 
1 1 1    2   25    5 o 118.0855 1.056856   110.7033   324.7   139.4746 2.495988          ?        ? 
1 1 1    2   25    6 o 194.5657 1.445139   225.0304    40.8   378.7587 5.623491          ?        ? 
1 1 1    2   25    7 o 135.5380 1.320141   131.6833    50.0   183.8009 3.578585          ?        ? 
1 1 1    2   25    8 o 15.00137 3.201460   15.17726   210.1   2.345627 0.9322364          ?        ? 
1 1 1    2   25    9 o 45.83122 1.345107   42.27247    69.9   21.02043 1.232958          ?        ? 
1 1 1    2   25   10 o 115.2601 1.252353   107.5454   321.2   132.9490 2.886926          ?        ? 
1 1 1    2   25   11 o 69.35855 1.170653   55.75528   266.1   48.14550 1.623896          ?        ? 
1 1 1    2   25   12 o 35.92736 1.715904   26.25962   267.7   12.93102 1.232958          ?        ? 
1 1 1    2   25   13 o 36.78624 1.757590   40.86796   353.7   13.56254 1.293102          ?        ? 
1 1 1    2   25   14 o 59.70012 1.259300   70.81159   253.0   35.69564 1.503607          ?        ? 
1 1 1    2   25   15 o 58.07135 1.372298   44.54126   122.9   33.80109 1.593824          ?        ? 
1 1 1    2   25   16 o 6.079492 2.927945   15.08838   242.4  -1.563751 1.052525          ?        ? 
1 1 1    2   25   17 o 19.07320 2.995673   20.91658   107.3   3.728946 1.142741          ?        ? 
1 1 1    2   25   18 o 35.95975 1.588917   28.69632   226.3   13.05131 1.142741          ?        ? 
1 1 1    2   25   19 o 10.93206 3.953504   14.59939   216.6   1.142741 1.112669          ?        ? 
1 1 1    2   25   20 o 43.49149 1.521188   47.85254   139.0   19.21610 1.323174          ?        ? 
1 1 1    2   25   21 o 7.006457 3.287096   7.225299    66.6 -0.9021643 1.172814          ?        ? 
1 1 1    2   26    0 o 113.3407 1.526240   115.5965   180.0   128.5584 3.458297   128.5584 3.458297 
1 1 1    2   26    1 f 185.0314 1.413963   207.8329   342.1   342.4917 5.232553          ?        ? 
1 1 1    2   26    2 o 298.1714 1.991891   282.1715   236.2   889.7145 11.87850          ?        ? 
1 1 1    2   26    3 o 139.0802 1.156785   146.1707   283.2   193.4842 3.217719          ?        ? 
1 1 1    2   26    4 o 142.4084 1.161425   135.6135   140.5   202.8667 3.307936          ?        ? 
1 1 1    2   26    5 o 102.6523 1.025331   115.3776    46.8   105.4029 2.105050          ?        ? 
1 1 1    2   26    6 f 253.4862 1.803241   239.9651   195.0   643.1830 9.141932          ?        ? 
1 1 1    2   26    7 o 26.45438 1.932483   16.21218   262.4   7.006810 1.022453          ?        ? 
1 1 1    2   26    8 o 164.5704 1.434440   190.6912   128.9   271.0703 4.721327          ?        ? 
1 1 1    2   26    9 f 182.8360 1.611865   190.9047   168.3   334.7030 5.894140          ?        ? 
1 1 1    2   26   10 o 74.15231 1.236914   70.88829   156.0   55.03202 1.834401          ?        ? 
1 1 1    2   26   11 o 151.4892 1.349869   133.5182   160.9   229.7211 4.089812          ?        ? 
1 1 1    2   26   12 o 73.12389 1.274873   81.85589   200.1   53.52842 1.864473          ?        ? 
1 1 1    2   26   13 o 41.35409 1.636170   49.08646   255.6   17.14112 1.353247          ?        ? 
1 1 1    2   26   14 o 42.51825 1.626735   46.69852    46.5   18.13350 1.383319          ?        ? 
1 1 1    2   26   15 o 17.81046 3.501677   19.11444   188.9   3.338008 1.202886          ?        ? 
1 1 1    2   26   16 o 47.76193 1.416658   64.07307   193.5   22.91497 1.353247          ?        ? 
1 1 1    2   26   17 o 56.73927 1.298514   54.41914    41.9   32.35763 1.473535          ?        ? 
1 1 1    2   26   18 o 12.02036 3.976716   12.78260   159.6   1.503607 1.112669          ?        ? 
1 1 1    2   26   19 o 14.11313 3.914230   22.44332    62.3   2.255411 1.142741          ?        ? 
1 1 1    2   26   20 o 20.42052 2.871655   22.78664    38.1   4.450677 1.172814          ?        ? 
1 1 1    2   26   21 o 20.38948 3.097260   17.67053   181.3   4.631110 1.263030          ?        ? 
1 1 1    2   27    0 o 136.8812 1.626260   129.2559    -0.0   187.4998 4.450677   187.4998 4.450677 
1 1 1    2   27    1 o 75.54128 0.9554135   98.61520    33.2   57.07693 1.443463          ?        ? 
1 1 1    2   27    2 o 44.44285 1.082636   40.27612   306.6   19.75740 0.9623086          ?        ? 
1 1 1    2   27    3 o 156.0745 1.348747   130.6129   163.0   243.7047 4.210100          ?        ? 
1 1 1    2   27    4 o 237.1429 1.711938   242.8120    56.8   562.8002 8.119479          ?        ? 
1 1 1    2   27    5 o 112.8937 1.172054   132.5259   145.5   127.5059 2.646349          ?        ? 
1 1 1    2   27    6 o 167.7860 1.335258   176.0590    80.4   281.6858 4.480750          ?        ? 
1 1 1    2   27    7 o 212.8633 1.702357   235.2572   255.7   453.6684 7.247387          ?        ? 
1 1 1    2   27    8 o 163.9028 1.394414   150.2233   161.0   268.8750 4.570966          ?        ? 
1 1 1    2   27    9 f 192.0524 1.722413   195.5805   251.6   369.3762 6.615872          ?        ? 
1 1 1    2   27   10 o 69.01044 1.220134   73.28554    69.3   47.66435 1.684040          ?        ? 
1 1 1    2   27   11 o 89.56371 1.208745   106.0080   146.1   80.29263 2.165194          ?        ? 
1 1 1    2   27   12 o 23.00944 2.679244   34.48815   290.1   5.322770 1.232958          ?        ? 
1 1 1    2   27   13 o 58.72747 1.382569   52.16916   178.0   34.55289 1.623896          ?        ? 
1 1 1    2   27   14 o 108.6425 1.300955   111.5372   106.9   118.2737 2.826782          ?        ? 
1 1 1    2   27   15 o 7.459414 3.458965   7.012695   323.6  -1.022453 1.232958          ?        ? 
1 1 1    2   27   16 o 39.04136 1.540528   30.70651   116.4   15.33679 1.202886          ?        ? 
1 1 1    2   27   17 f 45.76052 1.511476   42.13521   319.9   21.11065 1.383319          ?        ? 
1 1 1    2   27   18 o 22.12690 2.718153   11.86631   125.5   5.082192 1.202886          ?        ? 
1 1 1    2   27   19 f 30.86035 2.046364   29.40483   232.5   9.773447 1.263030          ?        ? 
1 1 1    2   27   20 o 15.65509 3.782540   19.91570   352.7   2.856854 1.172814          ?        ? 
1 1 1    2   27   21 o 58.08941 1.345987   51.83868   168.5   34.52282 1.563751          ?        ? 
1 1 1    2   28    0 o 359.6332 3.701017   345.8870     0.0   1296.049 26.61385   1296.049 26.61385 
1 1 1    2   28    1 f 147.8777 1.301492   131.8793   247.7   218.7749 3.849235          ?        ? 
1 1 1    2   28    2 o 101.5163 1.051615   112.9785   294.4   103.0873 2.135122          ?        ? 
1 1 1    2   28    3 o 91.40249 1.003474   84.14513   102.4   83.57049 1.834401          ?        ? 
1 1 1    2   28    4 o 42.85680 1.087618   54.08894   338.6   18.37408 0.9322364          ?        ? 
1 1 1    2   28    5 o 25.53390 1.589941   37.60080   129.6   6.525656 0.8119479          ?        ? 
1 1 1    2   28    6 o 58.04924 0.9842864   63.71456    88.2   33.71087 1.142741          ?        ? 
1 1 1    2   28    7 o 69.95241 1.053241   83.97837   231.3   48.95745 1.473535          ?        ? 
1 1 1    2   28    8 o 75.60825 1.073888   101.5827   261.5   57.19722 1.623896          ?        ? 
1 1 1    2   28    9 o 135.0878 1.369063   147.0711   282.1   182.6883 3.698874          ?        ? 
1 1 1    2   28   10 o 58.44035 1.389362   65.68806    81.2   34.19203 1.623896          ?        ? 
1 1 1    2   28   11 o 58.28251 1.367326   85.11407    35.3   34.01160 1.593824          ?        ? 
1 1 1    2   28   12 o 41.56238 1.736502   37.40585   160.5   17.32155 1.443463          ?        ? 
1 1 1    2   28   13 o 121.1205 1.353142   112.0102    12.5   147.0227 3.277864          ?        ? 
1 1 1    2   28   14 o 51.64660 1.484783   47.19592   253.8   26.76421 1.533679          ?        ? 
1 1 1    2   28   15 o 47.50039 1.487768   51.14652   124.1   22.67440 1.413391          ?        ? 
1 1 1    2   28   16 o 69.18297 1.260559   76.72463    12.4   48.08536 1.744184          ?        ? 
1 1 1    2   28   17 o 20.04478 2.925484   17.08249   111.8   4.149956 1.172814          ?        ? 
1 1 1    2   28   18 o 17.84072 3.237642   17.96791    17.0   3.458297 1.112669          ?        ? 
1 1 1    2   28   19 f 8.411330 3.700783   6.507603   175.6      -0.09 1.202886          ?        ? 
1 1 1    2   28   20 o 20.91319 2.875902   16.60322   359.2   4.751399 1.202886          ?        ? 
1 1 1    2   29    0 o 126.2942 1.643596   119.9301     0.0   159.6530 4.149956   159.6530 4.149956 
1 1 1    2   29    1 o 130.4030 1.118455   139.3077    54.7   170.1181 2.916998          ?        ? 
1 1 1    2   29    2 o 140.9316 1.248280   146.9789    82.0   198.7167 3.518441          ?        ? 
1 1 1    2   29    3 o 113.2171 1.022617   91.07360   311.0   128.2276 2.315555          ?        ? 
1 1 1    2   29    4 o 69.11371 0.9354891   74.45603   188.8   47.78464 1.293102          ?        ? 
1 1 1    2   29    5 o 169.5836 1.427501   165.9626   126.2   287.8205 4.841615          ?        ? 
1 1 1    2   29    6 o 193.6007 1.452342   205.3637   333.9   375.1801 5.623491          ?        ? 
1 1 1    2   29    7 o 29.55865 1.831270   22.58251   169.5   8.750995 1.082597          ?        ? 
1 1 1    2   29    8 o 116.1538 1.152102   112.5492   315.6   135.0239 2.676421          ?        ? 
1 1 1    2   29    9 o 43.52412 1.727327   38.96516    41.9   18.97552 1.503607          ?        ? 
1 1 1    2   29   10 o 86.17355 1.273747   69.59758   311.1   74.33834 2.195267          ?        ? 
1 1 1    2   29   11 o 45.86540 1.606369   45.60696   137.6   21.08057 1.473535          ?        ? 
1 1 1    2   29   12 o 159.5417 1.498502   120.8620    38.5   255.1020 4.781471          ?        ? 
1 1 1    2   29   13 o 57.70340 1.407106   51.84470   326.4   33.38008 1.623896          ?        ? 
1 1 1    2   29   14 o 63.80161 1.296180   54.56145    91.1   40.83797 1.653968          ?        ? 
1 1 1    2   29   15 o 43.88329 1.678925   41.64858   274.6   19.39653 1.473535          ?        ? 
1 1 1    2   29   16 o 56.77844 1.377064   48.85237   175.0   32.44785 1.563751          ?        ? 
1 1 1    2   29   17 o 36.73416 1.801013   41.48106   162.8   13.71290 1.323174          ?        ? 
1 1 1    2   29   18 o 41.23949 1.640717   42.34303   153.2   17.29148 1.353247          ?        ? 
1 1 1    2   29   19 o 29.71311 2.226584   26.04113   293.8   9.202076 1.323174          ?        ? 
1 1 1    2   29   20 o 7.712307 3.578938   13.58141   183.3 -0.6615872 1.323174          ?        ? 
1 1 1    2   30    0 o 100.4041 1.483305   100.4166     0.0   100.9221 2.977142   100.9221 2.977142 
1 1 1    2   30    1 o 271.5623 1.805022   310.7821    53.4   738.4816 9.803518          ?        ? 
1 1 1    2   30    2 o 138.3855 1.184324   157.6756    88.5   191.6197 3.277864          ?        ? 
1 1 1    2   30    3 o 77.65608 0.9100322   84.05522   185.6   60.32472 1.413391          ?        ? 
1 1 1    2   30    4 o 80.82204 0.9488003   83.43329   146.7   65.34677 1.533679          ?        ? 
1 1 1    2   30    5 o 166.5391 1.345255   145.1949   247.6   277.5959 4.480750          ?        ? 
1 1 1    2   30    6 o 40.87450 1.250723   36.45796   139.3   16.72011 1.022453          ?        ? 
1 1 1    2   30    7 o 140.3625 1.296190   146.1285   110.4   197.2131 3.638730          ?        ? 
1 1 1    2   30    8 o 103.3292 1.135026   111.6257    64.1   106.8463 2.345627          ?        ? 
1 1 1    2   30    9 o 103.0434 1.167358   100.2410    35.1   106.2750 2.405771          ?        ? 
1 1 1    2   30   10 o 106.3453 1.357336   110.9719    98.6   113.2517 2.886926          ?        ? 
1 1 1    2   30   11 o 12.79890 4.385608   10.72588   285.6   1.533679 1.353247          ?        ? 
1 1 1    2   30   12 o 76.49877 1.297251   57.75840   166.0   58.64068 1.984761          ?        ? 
1 1 1    2   30   13 o 89.28479 1.229362   87.45661   199.2   79.90170 2.195267          ?        ? 
1 1 1    2   30   14 o 94.74078 1.174435   76.61076   208.2   90.03600 2.225339          ?        ? 
1 1 1    2   30   15 o 48.55379 1.486457   47.27750   185.6   23.72692 1.443463          ?        ? 
1 1 1    2   30   16 f 39.20187 1.764353   39.93956    71.3   15.54730 1.383319          ?        ? 
1 1 1    2   30   17 o 9.703325 3.944937   7.002464   166.9  0.5412986 1.202886          ?        ? 
1 1 1    2   30   18 o 20.11640 3.064559   11.49626   193.4   4.300317 1.232958          ?        ? 
1 1 1    2   30   19 o 44.94682 1.706104   46.77349   264.2   20.74978 1.533679          ?        ? 
1 1 1    2   30   20 o 29.07664 2.378746   26.64050    47.6   9.081788 1.383319          ?        ? 
1 1 1    2   31    0 o 113.5308 1.430867   115.5053    -0.0   129.0095 3.247792   129.0095 3.247792 
1 1 1    2   31    1 o 212.7667 1.533523   207.3539   194.8   453.1572 6.525656          ?        ? 
1 1 1    2   31    2 o 69.24150 0.9771932   51.17890    81.1   47.96507 1.353247          ?        ? 
1 1 1    2   31    3 o 28.63535 1.575263   61.93274   321.2   8.209695 0.9021643          ?        ? 
1 1 1    2   31    4 o 183.2815 1.345426   176.9046   247.2   336.2066 4.931832          ?        ? 
1 1 1    2   31    5 o 124.4499 1.147793   100.5871   311.3   154.9918 2.856854          ?        ? 
1 1 1    2   31    6 o 146.1868 1.265119   144.2711   197.8   213.9032 3.698874          ?        ? 
1 1 1    2   31    7 o 65.20645 1.176018   38.01362   152.0   42.55209 1.533679          ?        ? 
1 1 1    2   31    8 o 55.13749 1.254427   40.23443   120.0   30.43301 1.383319          ?        ? 
1 1 1    2   31    9 o 47.51749 1.455589   40.84613   273.8   22.61425 1.383319          ?        ? 
1 1 1    2   31   10 o 48.21449 1.652847   37.99679   164.3   23.30591 1.593824          ?        ? 
1 1 1    2   31   11 o 84.68314 1.242898   72.61930   317.1   71.84235 2.105050          ?        ? 
1 1 1    2   31   12 o 78.89903 1.391187   71.76958   144.6   62.42978 2.195267          ?        ? 
1 1 1    2   31   13 o 111.5225 1.307807   111.5121   118.1   124.8295 2.916998          ?        ? 
1 1 1    2   31   14 o 61.02750 1.404377   60.69785    76.3   37.43982 1.714112          ?        ? 
1 1 1    2   31   15 o 50.63959 1.454924   42.82538   100.2   25.83197 1.473535          ?        ? 
1 1 1    2   31   16 o 9.369523 3.894093   24.89618   282.6  0.3608657 1.202886          ?        ? 
1 1 1    2   31   17 o 39.64242 1.782675   31.05642    98.4   16.02845 1.413391          ?        ? 
1 1 1    2   31   18 o 39.66103 1.743927   28.71249   179.2   16.11867 1.383319          ?        ? 
1 1 1    2   31   19 o 27.68423 2.335449   19.91015   356.7   8.149551 1.293102          ?        ? 
1 1 1    2   32    0 o 78.76994 1.356188   103.7985   180.0   62.12905 2.135122   62.12905 2.135122 
1 1 1    2   32    1 o 106.8715 1.041128   74.07642    39.7   114.2741 2.225339          ?        ? 
1 1 1    2   32    2 o 64.77557 1.021353   45.46661    17.4   41.98072 1.323174          ?        ? 
1 1 1    2   32    3 o 44.53297 1.181737   69.21637   139.6   19.84762 1.052525          ?        ? 
1 1 1    2   32    4 o 60.10145 1.075766   32.95125   156.3   36.14672 1.293102          ?        ? 
1 1 1    2   32    5 o 43.26411 1.285904   52.90017   258.5   18.73495 1.112669          ?        ? 
1 1 1    2   32    6 o 131.1807 1.169135   149.3608    57.4   172.2232 3.067359          ?        ? 
1 1 1    2   32    7 f 194.6763 1.444319   191.4661   340.1   379.5105 5.623491          ?        ? 
1 1 1    2   32    8 o 107.9690 1.267292   105.5846   296.9   116.7100 2.736565          ?        ? 
1 1 1    2   32    9 o 68.37945 1.231393   40.37398   297.3   46.82233 1.684040          ?        ? 
1 1 1    2   32   10 o 19.47423 3.685713   14.61931   143.6   3.969523 1.383319          ?        ? 
1 1 1    2   32   11 o 53.93118 1.505526   34.55018   149.0   29.16998 1.623896          ?        ? 
1 1 1    2   32   12 o 7.716966 3.595822   13.76911   284.1  -1.202886 1.353247          ?        ? 
1 1 1    2   32   13 o 26.67496 2.480181   27.49044   292.4   7.217315 1.323174          ?        ? 
1 1 1    2   32   14 o 26.57364 2.433055   21.77265    44.5   7.187243 1.293102          ?        ? 
1 1 1    2   32   15 o 14.08474 4.051974   17.35214    21.4   2.165194 1.202886          ?        ? 
1 1 1    2   32   16 o 12.66221 4.236901   4.638926   255.2   1.714112 1.263030          ?        ? 
1 1 1    2   32   17 o 28.78176 2.298634   26.84415     8.5   8.570561 1.323174          ?        ? 
1 1 1    2   32   18 o 12.44138 4.284810   9.121053    89.8   1.774257 1.293102          ?        ? 
1 1 1    2   32   19 o 25.28865 2.616143   22.45690   269.9   6.946666 1.323174          ?        ? 
1 1 1    2   33    0 o 28.56144 2.511223   18.85615   180.0   8.360056 1.413391   8.360056 1.413391 
1 1 1    2   33    1 f 77.18077 0.9935632   78.29773   357.5   59.60299 1.533679          ?        ? 
1 1 1    2   33    2 o 31.81386 1.512405   41.23516   107.2   10.13431 0.9623086          ?        ? 
1 1 1    2   33    3 o 49.06096 1.164614   41.47202   241.8   24.08779 1.142741          ?        ? 
1 1 1    2   33    4 o 100.4752 1.017618   60.03780   145.5   101.0123 2.044906          ?        ? 
1 1 1    2   33    5 o 83.31820 1.028654   92.27736   321.1   69.46665 1.714112          ?        ? 
1 1 1    2   33    6 o 127.3190 1.133737   120.0454   349.4   162.2392 2.886926          ?        ? 
1 1 1    2   33    7 o 71.65576 1.112139   62.61054    63.2   51.39330 1.593824          ?        ? 
1 1 1    2   33    8 o 14.76129 3.982380   41.99139   116.3   2.285483 1.202886          ?        ? 
1 1 1    2   33    9 o 100.7127 1.209303   90.64149    35.0   101.5837 2.435844          ?        ? 
1 1 1    2   33   10 o 162.7270 1.487649   155.7901    64.6   265.5070 4.841615          ?        ? 
1 1 1    2   33   11 o 53.40381 1.576704   51.82326    73.5   28.62868 1.684040          ?        ? 
1 1 1    2   33   12 o 65.75899 1.371926   64.93727   126.2   43.42418 1.804329          ?        ? 
1 1 1    2   33   13 o 34.04703 2.031482   34.36659    14.6   11.72814 1.383319          ?        ? 
1 1 1    2   33   14 o 42.39618 1.702350   48.76627   161.0   18.16358 1.443463          ?        ? 
1 1 1    2   33   15 o 20.46575 3.306124   17.15700   199.8   4.420605 1.353247          ?        ? 
1 1 1    2   33   16 o 24.57908 2.691669   18.95470    65.1   6.315150 1.323174          ?        ? 
1 1 1    2   33   17 o 7.041112 3.320459   3.288869    97.0  -1.142741 1.232958          ?        ? 
1 1 1    2   33   18 o 17.43603 3.730359   12.00928     2.2   3.608657 1.263030          ?        ? 
1 1 1    2   34    0 o 230.1071 2.372546   220.3804   180.0   530.5328 10.91619   530.5328 10.91619 
1 1 1    2   34    1 o 147.4104 1.193417   139.8288   110.9   217.4818 3.518441          ?        ? 
1 1 1    2   34    2 o 67.60825 1.045280   65.70543   190.4   45.73973 1.413391          ?        ? 
1 1 1    2   34    3 o 40.30976 1.380149   31.20057    46.4   16.26903 1.112669          ?        ? 
1 1 1    2   34    4 o 84.17936 1.018131   77.86156   342.6   70.91012 1.714112          ?        ? 
1 1 1    2   34    5 o 92.11794 1.060971   90.10114     6.4   84.92374 1.954689          ?        ? 
1 1 1    2   34    6 o 62.68527 1.127371   67.33421   157.2   39.33437 1.413391          ?        ? 
1 1 1    2   34    7 o 47.61156 1.294809   41.01649    99.5   22.70447 1.232958          ?        ? 
1 1 1    2   34    8 o 91.25987 1.103899   85.35439   250.8   83.39005 2.014834          ?        ? 
1 1 1    2   34    9 o 69.21719 1.216490   83.81734   248.4   47.99514 1.684040          ?        ? 
1 1 1    2   34   10 f 91.97160 1.291540   93.43723   329.0   84.80345 2.375700          ?        ? 
1 1 1    2   34   11 f 48.53485 1.641937   39.91725    42.4   23.69685 1.593824          ?        ? 
1 1 1    2   34   12 o 58.16317 1.421835   44.81516    17.4   34.01160 1.653968          ?        ? 
1 1 1    2   34   13 o 28.05981 2.679289   18.14120    16.5   8.059335 1.503607          ?        ? 
1 1 1    2   34   14 o 30.36472 2.376876   27.92633   123.2   9.442654 1.443463          ?        ? 
1 1 1    2   34   15 o 21.31401 3.245093   24.17359   283.1   4.811543 1.383319          ?        ? 
1 1 1    2   34   16 o 69.69973 1.380649   59.80019     1.6   49.19803 1.924617          ?        ? 
1 1 1    2   34   17 o 8.307637 3.750605   8.580159    98.3 -0.3307936 1.323174          ?        ? 
1 1 1    2   34   18 o 18.83131 3.806088   15.79955   233.9   4.270245 1.383319          ?        ? 
1 1 1    2   35    0 o 120.8691 1.505760   113.7012   360.0   146.2709 3.638730   146.2709 3.638730 
1 1 1    2   35    1 o 109.4983 1.057348   122.9383   299.1   119.9879 2.315555          ?        ? 
1 1 1    2   35    2 o 96.20465 1.047160   82.95008   267.9   92.62221 2.014834          ?        ? 
1 1 1    2   35    3 o 118.9965 1.124580   100.7421   215.3   141.7300 2.676421          ?        ? 
1 1 1    2   35    4 o 76.99522 1.035015   75.44398   330.6   59.33234 1.593824          ?        ? 
1 1 1    2   35    5 o 54.66705 1.182707   33.81045    64.5   29.92178 1.293102          ?        ? 
1 1 1    2   35    6 o 119.5528 1.157077   108.0977    17.5   143.1133 2.766637          ?        ? 
1 1 1    2   35    7 o 45.86461 1.376911   55.27368   246.6   21.08057 1.263030          ?        ? 
1 1 1    2   35    8 o 120.7856 1.282202   98.33694    81.2   146.1807 3.097431          ?        ? 
1 1 1    2   35    9 o 30.22922 2.138828   13.62436   283.1   9.202076 1.293102          ?        ? 
1 1 1    2   35   10 o 59.80876 1.458135   63.59980   285.6   35.93621 1.744184          ?        ? 
1 1 1    2   35   11 o 29.92965 2.361189   23.31032   235.7   9.081788 1.413391          ?        ? 
1 1 1    2   35   12 o 11.83749 4.308300   16.69047   336.2   1.263030 1.323174          ?        ? 
1 1 1    2   35   13 o 20.41341 3.240943   21.75532   286.7   4.330389 1.323174          ?        ? 
1 1 1    2   35   14 o 26.05606 2.654505   20.74952   223.6   7.036882 1.383319          ?        ? 
1 1 1    2   35   15 o 65.48772 1.423529   56.90517   261.0   43.42418 1.864473          ?        ? 
1 1 1    2   35   16 o 17.35250 4.127168   21.30222   239.0   3.548513 1.413391          ?        ? 
1 1 1    2   35   17 o 9.260358 4.021422   12.44557    60.2  0.3007214 1.383319          ?        ? 
1 1 1    2   36    0 o 44.84215 1.851037   48.17162   360.0   20.23855 1.653968   20.23855 1.653968 
1 1 1    2   36    1 o 103.7316 0.9856720   81.48894   239.5   107.6884 2.044906          ?        ? 
1 1 1    2   36    2 o 85.16396 1.024016   70.51730   271.1   72.59415 1.744184          ?        ? 
1 1 1    2   36    3 o 72.73309 1.074993   61.38467   322.4   52.95705 1.563751          ?        ? 
1 1 1    2   36    4 o 87.40280 1.049395   64.79369   304.6   76.47346 1.834401          ?        ? 
1 1 1    2   36    5 o 93.68291 1.091398   58.01704   301.4   87.87081 2.044906          ?        ? 
1 1 1    2   36    6 o 11.34981 3.968275   12.01160   322.8   1.172814 1.112669          ?        ? 
1 1 1    2   36    7 o 41.41843 1.452114   30.67194   280.4   17.20127 1.202886          ?        ? 
1 1 1    2   36    8 o 14.13847 3.979871   19.63564    24.8   2.105050 1.172814          ?        ? 
1 1 1    2   36    9 o 11.95197 3.976715   12.84797    89.7   1.413391 1.112669          ?        ? 
1 1 1    2   36   10 o 46.81882 1.702119   39.16671   189.1   22.07295 1.593824          ?        ? 
1 1 1    2   36   11 o 22.92202 2.886252   17.00544    92.8   5.382914 1.323174          ?        ? 
1 1 1    2   36   12 o 12.23815 4.409930   8.432331   196.6   1.413391 1.383319          ?        ? 
1 1 1    2   36   13 o 39.83871 1.962603   37.31907   110.8   16.17881 1.563751          ?        ? 
1 1 1    2   36   14 o 19.52494 3.833075   12.75931   150.5   4.270245 1.443463          ?        ? 
1 1 1    2   36   15 o 30.81126 2.244826   26.14476   279.3   9.833591 1.383319          ?        ? 
1 1 1    2   36   16 o 20.45816 3.380849   26.73659   284.3   4.631110 1.383319          ?        ? 
1 1 1    2   36   17 o 17.99831 4.027812   20.60574   297.5   3.999595 1.413391          ?        ? 
1 1 1    2   37    0 o 5.419048 3.802033   10.06917     0.0  -1.323174 1.473535  -1.323174 1.473535 
1 1 1    2   37    1 o 10.00874 3.763653   9.130771   228.2  0.7518036 1.022453          ?        ? 
1 1 1    2   37    2 o 71.28751 1.117884   68.71191   279.4   50.88207 1.593824          ?        ? 
1 1 1    2   37    3 o 65.14257 1.107926   36.84922   341.0   42.49194 1.443463          ?        ? 
1 1 1    2   37    4 o 72.05749 1.064205   43.21817   271.1   51.99474 1.533679          ?        ? 
1 1 1    2   37    5 o 55.25253 1.224601   47.19500     2.9   30.58337 1.353247          ?        ? 
1 1 1    2   37    6 o 39.86787 1.357732   33.24710    12.2   15.93824 1.082597          ?        ? 
1 1 1    2   37    7 o 46.14217 1.336043   30.86316    93.8   21.35122 1.232958          ?        ? 
1 1 1    2   37    8 o 53.16322 1.414142   62.15497   320.2   28.38811 1.503607          ?        ? 
1 1 1    2   37    9 o 75.41882 1.196206   80.62199   185.4   57.07693 1.804329          ?        ? 
1 1 1    2   37   10 o 43.00780 1.817986   39.46962   198.5   18.67480 1.563751          ?        ? 
1 1 1    2   37   11 o 10.38014 4.198135   4.372609   301.4  0.6014429 1.353247          ?        ? 
1 1 1    2   37   12 o 17.46752 4.037478   18.40990   207.3   3.398152 1.383319          ?        ? 
1 1 1    2   37   13 o 13.65646 4.380767   14.95497    74.7   2.074978 1.353247          ?        ? 
1 1 1    2   37   14 f 18.57550 4.077369   24.94927   164.8   3.939451 1.473535          ?        ? 
1 1 1    2   37   15 o 19.53807 3.675074   16.64301   170.7   4.360461 1.383319          ?        ? 
1 1 1    2   37   16 o 18.34676 3.964351   14.11404    21.7   4.089812 1.413391          ?        ? 
1 1 1    2   38    0 o 38.40143 2.088210   21.07033   180.0   14.91578 1.593824   14.91578 1.593824 
1 1 1    2   38    1 o 28.64314 1.889802   21.58019   288.3   8.239767 1.082597          ?        ? 
1 1 1    2   38    2 o 72.61973 1.055966   48.83575    70.9   52.80669 1.533679          ?        ? 
1 1 1    2   38    3 o 90.00574 1.102575   74.46737   282.8   81.13464 1.984761          ?        ? 
1 1 1    2   38    4 o 75.14719 1.060468   60.50694   241.3   56.56570 1.593824          ?        ? 
1 1 1    2   38    5 o 55.08095 1.173820   49.41082    12.7   30.40294 1.293102          ?        ? 
1 1 1    2   38    6 o 8.781236 3.614587   14.38166   266.2  0.2706493 1.022453          ?        ? 
1 1 1    2   38    7 o 61.19539 1.154818   52.76945   207.3   37.56011 1.413391          ?        ? 
1 1 1    2   38    8 o 80.50615 1.195323   63.07593   154.6   65.04605 1.924617          ?        ? 
1 1 1    2   38    9 o 25.20764 2.445604   17.12274   310.0   6.465511 1.232958          ?        ? 
1 1 1    2   38   10 o 31.52737 2.336914   29.42888   218.4   10.13431 1.473535          ?        ? 
1 1 1    2   38   11 o 20.06449 3.575594   7.809167   101.2   4.360461 1.383319          ?        ? 
1 1 1    2   38   12 o 33.91253 2.172553   28.81540   159.2   11.78828 1.473535          ?        ? 
1 1 1    2   38   13 o 44.29275 1.765246   36.80389    92.8   19.99798 1.563751          ?        ? 
1 1 1    2   38   14 o 49.27549 1.769830   37.21134    76.8   24.89974 1.744184          ?        ? 
1 1 1    2   38   15 o 21.08809 3.422461   25.24404   175.8   4.991976 1.443463          ?        ? 
1 1 1    2   38   16 o 22.82078 3.096718   17.14401   142.5   5.864068 1.413391          ?        ? 
1 1 1    2   39    0 o 37.30492 2.151144   43.17547   180.0   14.10384 1.593824   14.10384 1.593824 
1 1 1    2   39    1 o 47.36617 1.301518   61.80075   119.9   22.49397 1.232958          ?        ? 
1 1 1    2   39    2 o 24.91534 2.232900   29.92895   237.7   6.255006 1.112669          ?        ? 
1 1 1    2   39    3 o 20.90752 2.660931   17.48125    24.4   4.420605 1.112669          ?        ? 
1 1 1    2   39    4 o 65.70890 1.075494   68.42740     4.9   43.27382 1.413391          ?        ? 
1 1 1    2   39    5 o 31.77376 1.750925   35.34849   293.0   10.16438 1.112669          ?        ? 
1 1 1    2   39    6 o 72.93951 1.092565   66.27125   171.8   53.34798 1.593824          ?        ? 
1 1 1    2   39    7 o 65.99002 1.116483   74.77562     2.4   43.69483 1.473535          ?        ? 
1 1 1    2   39    8 o 45.76366 1.478516   33.16247    70.7   21.08057 1.353247          ?        ? 
1 1 1    2   39    9 o 11.34330 4.063218   7.091718   273.0   1.202886 1.172814          ?        ? 
1 1 1    2   39   10 o 59.05262 1.502267   60.57034    68.8   35.21448 1.774257          ?        ? 
1 1 1    2   39   11 o 25.66029 2.812640   19.50284   225.3   6.856449 1.443463          ?        ? 
1 1 1    2   39   12 o 12.02091 4.402177   11.57881   352.0   1.443463 1.383319          ?        ? 
1 1 1    2   39   13 o 37.84444 2.105757   29.70582   307.8   14.79550 1.593824          ?        ? 
1 1 1    2   39   14 o 13.30296 4.574720   11.57018   218.7   2.105050 1.473535          ?        ? 
1 1 1    2   39   15 o 11.69486 4.381673   10.19216   167.0   1.593824 1.383319          ?        ? 
1 1 1    2   40    0 o 94.80461 1.555222   55.61908   360.0   90.18636 2.947070   90.18636 2.947070 
1 1 1    2   40    1 o 66.98461 1.099906   55.18987   156.8   44.98793 1.473535          ?        ? 
1 1 1    2   40    2 o 78.35111 1.113057   61.26781   235.8   61.55768 1.744184          ?        ? 
1 1 1    2   40    3 o 24.32868 2.224940   20.43547   303.5   5.984357 1.082597          ?        ? 
1 1 1    2   40    4 o 57.23860 1.182110   48.75389    73.3   32.86885 1.353247          ?        ? 
1 1 1    2   40    5 o 8.654422 3.622587   11.60812   255.3  0.1804329 1.052525          ?        ? 
1 1 1    2   40    6 o 15.27147 3.340950   5.232097   263.5   2.495988 0.9923807          ?        ? 
1 1 1    2   40    7 o 46.38779 1.393796   41.32314    57.7   21.65195 1.293102          ?        ? 
1 1 1    2   40    8 o 57.55454 1.358495   55.48568   120.4   33.35001 1.563751          ?        ? 
1 1 1    2   40    9 o 52.45030 1.404696   44.85710    52.8   27.75659 1.473535          ?        ? 
1 1 1    2   40   10 o 15.79301 4.275079   13.09052   184.6   2.826782 1.383319          ?        ? 
1 1 1    2   40   11 o 14.57019 4.388237   13.19990   254.3   2.435844 1.383319          ?        ? 
1 1 1    2   40   12 o 22.32460 3.232898   27.81238   294.3   5.352841 1.443463          ?        ? 
1 1 1    2   40   13 o 27.99161 2.578385   21.60350   165.7   8.299912 1.443463          ?        ? 
1 1 1    2   40   14 o 10.64973 4.353990   7.031340   359.8   1.022453 1.473535          ?        ? 
1 1 1    2   41    0 o 8.594244 5.110093   10.53666   180.0  0.9021643 1.503607  0.9021643 1.503607 
1 1 1    2   41    1 o 29.95625 1.857157   27.39745    78.1   9.051716 1.112669          ?        ? 
1 1 1    2   41    2 o 19.66337 2.676360   27.44949   210.5   3.939451 1.052525          ?        ? 
1 1 1    2   41    3 o 58.87261 1.174841   29.09520   323.4   34.79347 1.383319          ?        ? 
1 1 1    2   41    4 o 37.28746 1.653314   33.27922   101.2   14.01362 1.232958          ?        ? 
1 1 1    2   41    5 o 49.53898 1.244432   29.62726   103.7   24.65916 1.232958          ?        ? 
1 1 1    2   41    6 o 82.27595 1.059960   71.08791    26.9   67.96305 1.744184          ?        ? 
1 1 1    2   41    7 o 29.87062 1.963156   20.78114   190.3   9.051716 1.172814          ?        ? 
1 1 1    2   41    8 o 40.10632 1.649583   31.99543   260.0   16.29910 1.323174          ?        ? 
1 1 1    2   41    9 o 38.35558 1.842484   36.32394   281.2   14.97593 1.413391          ?        ? 
1 1 1    2   41   10 o 14.82337 4.371591   20.74599   153.0   2.526060 1.383319          ?        ? 
1 1 1    2   41   11 o 19.01179 4.072319   22.06212   235.8   4.149956 1.503607          ?        ? 
1 1 1    2   41   12 o 12.60836 4.466098   16.20951    83.1   1.804329 1.413391          ?        ? 
1 1 1    2   41   13 o 16.68017 4.300534   6.204482   112.7   3.488369 1.443463          ?        ? 
1 1 1    2   42    0 o 58.79908 1.639422   63.80901     0.0   34.79347 1.924617   34.79347 1.924617 
1 1 1    2   42    1 o 29.82848 1.865112   34.97034   328.7   8.991571 1.112669          ?        ? 
1 1 1    2   42    2 o 7.278965 3.321133   7.934788   226.6 -0.6615872 1.082597          ?        ? 
1 1 1    2   42    3 o 32.87409 1.738058   24.69545   184.9   10.91619 1.142741          ?        ? 
1 1 1    2   42    4 o 49.89908 1.295718   35.12479    70.7   25.05010 1.293102          ?        ? 
1 1 1    2   42    5 o 24.65756 2.256244   20.81834    66.3   6.194862 1.112669          ?        ? 
1 1 1    2   42    6 o 13.55654 3.826212   13.20432   134.9   2.014834 1.082597          ?        ? 
1 1 1    2   42    7 o 28.77920 1.985361   24.08253    16.7   8.450273 1.142741          ?        ? 
1 1 1    2   42    8 o 20.77457 3.039845   16.63366   178.3   4.540894 1.263030          ?        ? 
1 1 1    2   42    9 f 6.989319 3.336555   2.180743   354.4  -1.473535 1.293102          ?        ? 
1 1 1    2   42   10 o 36.73259 2.128561   34.45657    90.6   13.92340 1.563751          ?        ? 
1 1 1    2   42   11 o 9.931791 4.272475   13.39767   143.1  0.3608657 1.533679          ?        ? 
1 1 1    2   42   12 o 27.27498 2.866641   19.90600    98.1   8.119479 1.563751          ?        ? 
1 1 1    2   42   13 o 11.63661 4.411737   3.356631   285.2   1.593824 1.413391          ?        ? 
1 1 1    2   43    0 o 14.31466 5.478914   11.79671     0.0   2.886926 1.473535   2.886926 1.473535 
1 1 1    2   43    1 o 18.05490 2.998070   18.14454   215.3   3.368080 1.082597          ?        ? 
1 1 1    2   43    2 o 51.49511 1.255558   34.05965   129.0   26.67399 1.293102          ?        ? 
1 1 1    2   43    3 o 16.17607 3.364836   12.27040   130.9   2.826782 1.052525          ?        ? 
1 1 1    2   43    4 o 17.89696 3.317095   20.81854    20.0   3.458297 1.142741          ?        ? 
1 1 1    2   43    5 o 10.64890 3.894915   9.148189   156.1   1.052525 1.082597          ?        ? 
1 1 1    2   43    6 o 37.86018 1.588589   33.80262    68.1   14.52485 1.202886          ?        ? 
1 1 1    2   43    7 o 14.97725 3.725359   14.23643   169.2   2.526060 1.112669          ?        ? 
1 1 1    2   43    8 o 21.45547 2.873295   31.48203    40.9   4.841615 1.232958          ?        ? 
1 1 1    2   43    9 o 29.72394 2.276358   27.25912    49.1   9.172004 1.353247          ?        ? 
1 1 1    2   43   10 o 7.154487 3.450260   4.133397   309.4  -1.834401 1.473535          ?        ? 
1 1 1    2   43   11 o 13.78880 4.668845   18.53378   120.8   2.405771 1.533679          ?        ? 
1 1 1    2   43   12 o 8.266921 3.797621   6.379071    27.9 -0.4510822 1.443463          ?        ? 
1 1 1    2   44    0 o 65.73192 1.626322   51.81754   180.0   43.57454 2.135122   43.57454 2.135122 
1 1 1    2   44    1 o 25.53120 2.179038   10.69876    59.1   6.676016 1.112669          ?        ? 
1 1 1    2   44    2 o 22.05142 2.522897   21.63889   359.3   5.022048 1.112669          ?        ? 
1 1 1    2   44    3 o 15.85494 3.507436   18.36374   310.5   2.766637 1.082597          ?        ? 
1 1 1    2   44    4 o 52.55119 1.316163   40.36274   249.3   27.87688 1.383319          ?        ? 
1 1 1    2   44    5 o 24.82328 2.362326   15.55023   336.4   6.375295 1.172814          ?        ? 
1 1 1    2   44    6 o 8.417355 3.655186   2.802803    18.7   0.000000 1.142741          ?        ? 
1 1 1    2   44    7 o 79.57647 1.171498   56.85456   185.3   63.90331 1.864473          ?        ? 
1 1 1    2   44    8 o 14.22977 4.171057   7.435276   163.1   2.375700 1.263030          ?        ? 
1 1 1    2   44    9 o 34.12941 1.982523   32.15438   116.6   12.05893 1.353247          ?        ? 
1 1 1    2   44   10 o 19.15225 4.121971   14.32288    39.4   4.480750 1.533679          ?        ? 
1 1 1    2   44   11 o 13.32723 4.658996   18.46254   320.5   2.315555 1.533679          ?        ? 
1 1 1    2   45    0 o 20.03313 4.374961   24.47801   360.0   4.721327 1.533679   4.721327 1.533679 
1 1 1    2   45    1 o 60.60266 1.190924   51.10873   205.3   37.04888 1.443463          ?        ? 
1 1 1    2   45    2 o 58.97496 1.198297   39.21678    57.4   35.09419 1.413391          ?        ? 
1 1 1    2   45    3 o 44.23690 1.427575   28.91758   120.4   19.81754 1.263030          ?        ? 
1 1 1    2   45    4 o 40.80689 1.547570   30.00773    71.6   16.90055 1.263030          ?        ? 
1 1 1    2   45    5 o 9.766757 3.821623   9.700871    41.7  0.7518036 1.082597          ?        ? 
1 1 1    2   45    6 o 58.54721 1.284098   48.48368   156.2   34.70325 1.503607          ?        ? 
1 1 1    2   45    7 f 21.03305 2.645050   12.28798    32.2   4.691255 1.112669          ?        ? 
1 1 1    2   45    8 o 19.12498 3.144802   15.91526   234.2   3.999595 1.202886          ?        ? 
1 1 1    2   45    9 o 7.373188 3.466141   5.927773   338.7 -0.9623086 1.323174          ?        ? 
1 1 1    2   45   10 o 32.95607 2.646227   28.55815   244.0   11.84843 1.744184          ?        ? 
1 1 1    2   46    0 o 12.09452 5.831106   13.11799     0.0   2.375700 1.623896   2.375700 1.623896 
1 1 1    2   46    1 o 14.16749 3.908216   14.30453   176.2   2.285483 1.142741          ?        ? 
1 1 1    2   46    2 o 47.47780 1.425136   34.21267   284.9   22.85483 1.353247          ?        ? 
1 1 1    2   46    3 f 34.08270 1.764658   26.56798   277.5   11.87850 1.202886          ?        ? 
1 1 1    2   46    4 o 19.98412 2.783884   13.55135   305.7   4.240172 1.112669          ?        ? 
1 1 1    2   46    5 o 24.03354 2.565078   15.72773    12.8   6.104645 1.232958          ?        ? 
1 1 1    2   46    6 o 22.54496 2.667748   10.08220   135.2   5.412986 1.202886          ?        ? 
1 1 1    2   46    7 o 7.282339 3.375585   8.556951    59.0 -0.6615872 1.172814          ?        ? 
1 1 1    2   46    8 o 9.986583 4.080102   5.613851   266.4  0.8420200 1.293102          ?        ? 
1 1 1    2   47    0 o 7.928138 4.933366   6.389390   360.0  0.7217315 1.533679  0.7217315 1.533679 
1 1 1    2   47    1 o 25.78451 2.274260   29.48788   132.0   6.946666 1.172814          ?        ? 
1 1 1    2   47    2 o 32.55510 1.847461   17.29222   173.8   10.91619 1.202886          ?        ? 
1 1 1    2   47    3 o 38.77920 1.628489   26.33686   277.5   15.39694 1.263030          ?        ? 
1 1 1    2   47    4 o 48.32203 1.400238   35.13644   238.9   23.78707 1.353247          ?        ? 
1 1 1    2   47    5 o 37.89171 1.666631   26.19462    87.4   14.79550 1.263030          ?        ? 
1 1 1    2   47    6 o 15.79546 3.761273   16.60455    17.8   3.007215 1.172814          ?        ? 
1 1 1    2   47    7 o 17.06395 3.632933   13.45279    51.1   3.488369 1.202886          ?        ? 
1 1 1    2   48    0 o 6.839699 4.534699   1.422934   180.0       0.06 1.563751       0.06 1.563751 
1 1 1    2   48    1 o 29.50913 2.038158   23.60555   113.4   9.111859 1.202886          ?        ? 
1 1 1    2   48    2 o 20.15713 2.983773   25.70742   199.5   4.480750 1.202886          ?        ? 
1 1 1    2   48    3 o 21.47941 2.730088   18.68171   183.3   5.022048 1.172814          ?        ? 
1 1 1    2   48    4 o 22.46076 2.343031   23.97498   343.7   5.382914 1.052525          ?        ? 
1 1 1    2   48    5 o 15.62872 3.864939   8.133002   104.6   3.007215 1.202886          ?        ? 
1 1 1    2   49    0 o 28.50159 3.237027   31.83638   180.0   8.961499 1.804329   8.961499 1.804329 
1 1 1    2   49    1 o 33.84166 1.688365   19.77148   122.8   11.87850 1.142741          ?        ? 
1 1 1    3    0    1 o 241.9705 2.448883   83.30676   270.0   585.8354 11.84843   585.8354 11.84843 
1 1 1    3    0    2 o 116.3275 1.370545   400.6905   270.0   135.3848 3.187647   135.3848 3.187647 
1 1 1    3    0    3 o 310.2211 3.878871   65.99870    90.0   963.1205 24.05772   963.1205 24.05772 
1 1 1    3    0    4 o 209.8645 2.192923   7.105265   270.0   440.6170 9.202076   440.6170 9.202076 
1 1 1    3    0    5 o 111.6727 1.333403   199.0947    90.0   124.7693 2.977142   124.7693 2.977142 
1 1 1    3    0    6 o 216.0732 2.276090   262.1279    90.0   467.1407 9.833591   467.1407 9.833591 
1 1 1    3    0    7 o 48.24439 0.9982792   105.4387   270.0   23.30591 0.9623086   23.30591 0.9623086 
1 1 1    3    0    8 o 75.81407 1.270098   214.5639   270.0   57.52802 1.924617   57.52802 1.924617 
1 1 1    3    0    9 o 719.1417 11.45173   857.5895   270.0   5188.137 164.6149   5188.137 164.6149 
1 1 1    3    0   10 o 5.150514 3.453862   35.94859   270.0 -0.3007214 0.9623086 -0.3007214 0.9623086 
1 1 1    3    0   11 o 384.1073 4.604996   487.8458    90.0   1477.054 35.36484   1477.054 35.36484 
1 1 1    3    0   12 o 50.94804 1.330073   76.73737   270.0   26.01241 1.353247   26.01241 1.353247 
1 1 1    3    0   13 o 42.00914 1.435366   50.61505   270.0   17.71249 1.202886   17.71249 1.202886 
1 1 1    3    0   14 o 162.5873 2.026017   129.7847   270.0   264.6048 6.585800   264.6048 6.585800 
1 1 1    3    0   15 f 259.9183 2.748528   290.4124   270.0   676.6232 14.28427   676.6232 14.28427 
1 1 1    3    0   16 o 7.482764 4.317702       0.05   270.0  0.7217315 1.022453  0.7217315 1.022453 
1 1 1    3    0   17 o 39.64988 2.136713   5.311388    90.0   15.87809 1.684040   15.87809 1.684040 
1 1 1    3    0   18 o 75.82323 1.786943   89.25153    90.0   57.64830 2.706493   57.64830 2.706493 
1 1 1    3    0   19 o 21.48120 4.145661   59.28472    90.0   5.112265 1.593824   5.112265 1.593824 
1 1 1    3    0   20 o 22.78180 4.889849   35.60077    90.0   5.924213 1.954689   5.924213 1.954689 
1 1 1    3    0   21 o 45.06752 2.757149   52.11681   270.0   20.71971 2.465916   20.71971 2.465916 
1 1 1    3    0   22 o 54.27148 2.589183   33.52988    90.0   30.01200 2.796710   30.01200 2.796710 
1 1 1    3    0   23 o 66.10655 2.555769   63.27194    90.0   44.68721 3.368080   44.68721 3.368080 
1 1 1    3    0   24 o 14.92091 6.812255   13.64614   270.0   3.728946 2.195267   3.728946 2.195267 
1 1 1    3    0   25 o 8.117919 5.429694  0.1339907   270.0  0.1804329 2.345627  0.1804329 2.345627 
1 1 1    3    1    0 o 147.3022 1.408944   624.7387   180.0   217.0607 4.149956   217.0607 4.149956 
1 1 1    3    1    1 o 293.6132 2.263503   1256.339   319.9   862.4691 13.29189          ?        ? 
1 1 1    3    1    2 o 52.54127 0.4865000   480.1507   201.8   27.60623 0.5112265          ?        ? 
1 1 1    3    1    3 o 75.68754 0.7747733   180.4481   118.3   57.28744 1.172814          ?        ? 
1 1 1    3    1    4 o 51.26665 0.5865830   455.9437   115.7   26.28305 0.6014429          ?        ? 
1 1 1    3    1    5 o 113.4986 1.006833   98.14915   322.0   128.8291 2.285483          ?        ? 
1 1 1    3    1    6 o 179.9857 1.294876   177.0269   235.1   323.9973 4.661182          ?        ? 
1 1 1    3    1    7 o 198.5038 1.446768   102.4512   280.6   394.0955 5.743780          ?        ? 
1 1 1    3    1    8 o 176.2705 1.339228   218.9805   231.5   310.7355 4.721327          ?        ? 
1 1 1    3    1    9 o 265.8766 2.409151   352.1813   147.9   707.0563 12.81073          ?        ? 
1 1 1    3    1   10 o 332.4646 2.559796   369.5347   115.0   1105.662 17.02083          ?        ? 
1 1 1    3    1   11 o 91.03353 1.189229   86.98373   221.1   82.87883 2.165194          ?        ? 
1 1 1    3    1   12 o 112.0559 1.113724   122.9210    97.7   125.5813 2.495988          ?        ? 
1 1 1    3    1   13 o 23.45289 1.731019   73.45267    17.2   5.503202 0.8119479          ?        ? 
1 1 1    3    1   14 o 139.2036 1.188164   125.4815    57.1   193.8450 3.307936          ?        ? 
1 1 1    3    1   15 o 88.61227 1.035072   119.5971   299.0   78.54845 1.834401          ?        ? 
1 1 1    3    1   16 o 55.66667 1.080436   59.21449    34.7   31.00438 1.202886          ?        ? 
1 1 1    3    1   17 o 97.02737 1.162255   122.3346   223.5   94.21603 2.255411          ?        ? 
1 1 1    3    1   18 o 54.26472 1.108350   44.36380   166.2   29.47070 1.202886          ?        ? 
1 1 1    3    1   19 o 41.93917 1.398232   33.98145   193.0   17.62228 1.172814          ?        ? 
1 1 1    3    1   20 o 85.05497 1.308177   84.55530   144.3   72.53401 2.225339          ?        ? 
1 1 1    3    1   21 o 26.46864 2.329092   35.48088    81.6   7.097026 1.232958          ?        ? 
1 1 1    3    1   22 o 82.96390 1.431767   82.02859   355.5   69.34637 2.375700          ?        ? 
1 1 1    3    1   23 o 26.92375 2.848190   31.50522   202.9   7.578181 1.533679          ?        ? 
1 1 1    3    1   24 x        ?      ?   12.51816    82.0          ?        ?          ?        ? 
1 1 1    3    1   25 x        ?      ?   32.34118   108.1          ?        ?          ?        ? 
1 1 1    3    2    0 o 64.56899 1.235211   149.8798   180.0   41.74014 1.593824   41.74014 1.593824 
1 1 1    3    2    1 f 69.94622 0.8383682   578.5497    59.4   48.92738 1.172814          ?        ? 
1 1 1    3    2    2 o 408.9135 2.757809   1052.720   218.2   1672.793 22.55411          ?        ? 
1 1 1    3    2    3 o 540.9017 3.991816   710.8966   251.3   2927.583 43.18360          ?        ? 
1 1 1    3    2    4 o 241.4219 1.743877   88.37482   171.2   582.9185 8.420200          ?        ? 
1 1 1    3    2    5 o 160.9657 1.261057   272.5992   295.7   259.1317 4.059740          ?        ? 
1 1 1    3    2    6 o 120.6379 1.046959   192.9538    44.5   145.5492 2.526060          ?        ? 
1 1 1    3    2    7 o 281.8452 1.904549   384.7288   244.9   794.5662 10.73576          ?        ? 
1 1 1    3    2    8 o 465.0880 2.951686   503.8521   148.9   2163.811 27.45587          ?        ? 
1 1 1    3    2    9 o 294.7956 2.591058   298.7690    74.0   869.2654 15.27665          ?        ? 
1 1 1    3    2   10 o 204.4882 1.735314   214.1417    89.2   418.2133 7.097026          ?        ? 
1 1 1    3    2   11 o 367.4962 2.819037   491.6802   229.1   1351.262 20.71971          ?        ? 
1 1 1    3    2   12 o 291.2949 2.162796   330.5725   283.8   848.9366 12.60023          ?        ? 
1 1 1    3    2   13 o 77.83698 0.9465521   102.6532   302.7   60.59537 1.473535          ?        ? 
1 1 1    3    2   14 o 39.34631 1.222870   69.24658   145.7   15.48715 0.9623086          ?        ? 
1 1 1    3    2   15 o 95.18539 1.089967   97.58969    96.5   90.63744 2.074978          ?        ? 
1 1 1    3    2   16 o 85.93633 1.032309   118.4357   102.5   73.88726 1.774257          ?        ? 
1 1 1    3    2   17 o 99.56689 1.132611   106.7604    73.4   99.20800 2.255411          ?        ? 
1 1 1    3    2   18 o 54.84229 1.124094   49.94704   248.9   30.10222 1.232958          ?        ? 
1 1 1    3    2   19 o 56.03811 1.314762   56.36432   253.9   31.45546 1.473535          ?        ? 
1 1 1    3    2   20 o 34.07266 1.809307   38.59052    31.3   11.66799 1.232958          ?        ? 
1 1 1    3    2   21 o 37.05657 1.744768   55.31949   229.3   13.83319 1.293102          ?        ? 
1 1 1    3    2   22 o 40.44507 2.007533   38.68854   101.3   16.59982 1.623896          ?        ? 
1 1 1    3    2   23 o 22.37436 3.494517   12.10414   327.7   5.352841 1.563751          ?        ? 
1 1 1    3    2   24 o 19.56117 5.937694   17.21573   322.9   5.142337 2.526060          ?        ? 
1 1 1    3    2   25 o 12.16583 5.341917   19.37602   247.7   1.232958 2.495988          ?        ? 
1 1 1    3    3    0 o 105.7351 1.707458   536.6475    -0.0   111.8985 3.608657   111.8985 3.608657 
1 1 1    3    3    1 o 312.6551 2.736410   1050.275   176.2   978.0063 17.11105          ?        ? 
1 1 1    3    3    2 o 259.4224 2.034389   741.3273   262.6   673.1349 10.55532          ?        ? 
1 1 1    3    3    3 o 425.2935 2.892004   879.4626    54.1   1809.321 24.59902          ?        ? 
1 1 1    3    3    4 o 324.2643 2.262846   449.2544    69.8   1051.713 14.67521          ?        ? 
1 1 1    3    3    5 o 126.1804 1.132051   103.1592    48.3   159.2320 2.856854          ?        ? 
1 1 1    3    3    6 o 232.2361 1.845226   445.0092    55.8   539.4943 8.570561          ?        ? 
1 1 1    3    3    7 o 258.0160 2.086272   310.0404   312.7   665.9175 10.76583          ?        ? 
1 1 1    3    3    8 o 299.3702 2.400788   440.5730   325.6   896.4205 14.37449          ?        ? 
1 1 1    3    3    9 o 287.9893 2.239832   366.0266   196.7   829.5401 12.90095          ?        ? 
1 1 1    3    3   10 o 343.9036 2.452791   486.4237   227.8   1183.038 16.87047          ?        ? 
1 1 1    3    3   11 o 280.3900 2.300537   306.6994   148.1   786.4768 12.90095          ?        ? 
1 1 1    3    3   12 o 72.51978 0.9537527   135.8316   268.9   52.59618 1.383319          ?        ? 
1 1 1    3    3   13 o 25.24440 1.489050   55.20608   332.3   6.375295 0.7518036          ?        ? 
1 1 1    3    3   14 o 39.42396 1.106043   63.49511   165.3   15.54730 0.8720922          ?        ? 
1 1 1    3    3   15 o 58.64452 0.9742952   76.53956   123.1   34.40253 1.142741          ?        ? 
1 1 1    3    3   16 o 119.1061 1.262410   157.7085   200.0   141.9706 3.007215          ?        ? 
1 1 1    3    3   17 o 83.76634 1.130851   89.72798   319.7   70.21846 1.894545          ?        ? 
1 1 1    3    3   18 o 28.14675 1.762869   30.78158   345.2   7.939046 0.9923807          ?        ? 
1 1 1    3    3   19 o 15.94926 3.576846   25.25215   250.3   2.676421 1.112669          ?        ? 
1 1 1    3    3   20 o 37.34480 1.771564   43.13925   331.5   14.01362 1.323174          ?        ? 
1 1 1    3    3   21 o 28.26828 2.234006   23.65351   227.9   8.089407 1.263030          ?        ? 
1 1 1    3    3   22 o 34.80421 2.203296   39.65119   170.3   12.32958 1.533679          ?        ? 
1 1 1    3    3   23 o 13.61283 4.908603   20.83153   137.3   1.954689 1.714112          ?        ? 
1 1 1    3    3   24 o 62.40520 2.048012   61.01805   154.0   40.29667 2.556132          ?        ? 
1 1 1    3    3   25 o 8.605216 4.010331   8.936369   166.0 -0.7217315 1.684040          ?        ? 
1 1 1    3    4    0 o 99.78567 1.628353   613.5334     0.0   99.65909 3.247792   99.65909 3.247792 
1 1 1    3    4    1 o 207.2784 1.581382   752.9485   175.6   429.7009 6.555727          ?        ? 
1 1 1    3    4    2 o 446.8338 3.758733   617.7646   274.0   1997.813 33.59058          ?        ? 
1 1 1    3    4    3 o 287.7282 2.058961   530.4477    59.8   828.0064 11.84843          ?        ? 
1 1 1    3    4    4 o 107.5135 1.006941   179.0372   310.4   115.5973 2.165194          ?        ? 
1 1 1    3    4    5 o 109.6302 0.9874987   115.6743   277.4   120.1984 2.165194          ?        ? 
1 1 1    3    4    6 o 217.8519 1.780709   284.7244    95.0   474.7189 7.758613          ?        ? 
1 1 1    3    4    7 o 315.7572 2.423812   487.3296   202.9   997.4028 15.30672          ?        ? 
1 1 1    3    4    8 o 242.8786 1.999621   260.7026   116.8   589.9854 9.713303          ?        ? 
1 1 1    3    4    9 o 166.0986 1.484610   113.0292   330.8   275.9119 4.931832          ?        ? 
1 1 1    3    4   10 o 228.7298 1.774906   279.9379   255.8   523.2553 8.119479          ?        ? 
1 1 1    3    4   11 o 116.1815 1.113001   144.5848   247.2   134.9939 2.586205          ?        ? 
1 1 1    3    4   12 o 149.6146 1.326583   212.1249   246.4   223.8871 3.969523          ?        ? 
1 1 1    3    4   13 o 80.81194 0.9675250   62.15596   142.1   65.31670 1.563751          ?        ? 
1 1 1    3    4   14 o 81.77171 0.9193932   115.7042   258.5   66.88045 1.503607          ?        ? 
1 1 1    3    4   15 o 65.15330 0.9231197   72.87662   144.5   42.46187 1.202886          ?        ? 
1 1 1    3    4   16 o 125.3306 1.199713   147.3272    85.5   157.1871 3.007215          ?        ? 
1 1 1    3    4   17 o 113.0426 1.064099   105.2690   256.8   127.8668 2.405771          ?        ? 
1 1 1    3    4   18 o 67.69355 1.066175   59.64432    61.1   45.86002 1.443463          ?        ? 
1 1 1    3    4   19 o 60.89194 1.284038   59.37667   115.2   37.13910 1.563751          ?        ? 
1 1 1    3    4   20 o 45.29240 1.327911   45.48027   283.3   20.56935 1.202886          ?        ? 
1 1 1    3    4   21 o 71.64991 1.259128   74.90366   113.3   51.54366 1.804329          ?        ? 
1 1 1    3    4   22 f 23.30480 2.258173   25.29697    27.7   5.533275 1.052525          ?        ? 
1 1 1    3    4   23 o 20.52831 3.949701   19.87517   140.4   4.721327 1.563751          ?        ? 
1 1 1    3    4   24 o 11.90556 4.641375   6.616980   113.9   1.383319 1.593824          ?        ? 
1 1 1    3    4   25 o 11.82850 4.724451   5.782607   221.7   1.563751 1.684040          ?        ? 
1 1 1    3    5    0 o 157.8132 1.648707   52.05991   360.0   249.1477 5.202481   249.1477 5.202481 
1 1 1    3    5    1 o 177.7382 1.446604   422.9272   298.4   315.9380 5.142337          ?        ? 
1 1 1    3    5    2 o 342.7892 2.416901   536.3298   106.0   1175.310 16.56975          ?        ? 
1 1 1    3    5    3 o 154.6348 1.244621   418.9282   114.6   239.1337 3.849235          ?        ? 
1 1 1    3    5    4 o 183.6268 1.416591   181.3165    62.3   337.2290 5.202481          ?        ? 
1 1 1    3    5    5 o 212.3289 1.734967   403.8314    25.8   450.9619 7.367675          ?        ? 
1 1 1    3    5    6 o 296.0652 2.549475   410.7749   243.0   876.9940 15.09622          ?        ? 
1 1 1    3    5    7 o 238.9697 1.919072   326.7299   219.4   571.1903 9.172004          ?        ? 
1 1 1    3    5    8 o 331.7754 2.560582   470.0426   249.9   1101.001 16.99076          ?        ? 
1 1 1    3    5    9 o 602.8565 4.392177   716.5162   302.2   3637.316 52.95705          ?        ? 
1 1 1    3    5   10 o 477.7587 3.581526   562.3647    89.5   2284.070 34.22210          ?        ? 
1 1 1    3    5   11 o 109.7809 1.054625   146.2937   313.5   120.5292 2.315555          ?        ? 
1 1 1    3    5   12 o 262.5458 1.930008   296.0549    81.4   689.5844 10.13431          ?        ? 
1 1 1    3    5   13 f 354.7328 2.496597   398.3112   349.2   1259.782 17.71249          ?        ? 
1 1 1    3    5   14 o 59.91447 0.9787399   97.06138     9.6   35.90614 1.172814          ?        ? 
1 1 1    3    5   15 o 37.90577 1.071008   48.10957   322.8   14.37449 0.8119479          ?        ? 
1 1 1    3    5   16 o 39.94807 1.129171   16.57156   156.1   15.96831 0.9021643          ?        ? 
1 1 1    3    5   17 o 69.45621 0.9525242   82.69928   256.7   48.26579 1.323174          ?        ? 
1 1 1    3    5   18 o 62.64666 1.008059   71.01361    60.5   39.27422 1.263030          ?        ? 
1 1 1    3    5   19 o 80.56345 1.101155   81.25043   338.0   64.98591 1.774257          ?        ? 
1 1 1    3    5   20 o 31.26116 2.020127   32.91062   351.3   9.833591 1.263030          ?        ? 
1 1 1    3    5   21 o 61.05140 1.305313   67.71840    66.9   37.43982 1.593824          ?        ? 
1 1 1    3    5   22 o 40.92101 1.726975   33.04048   226.7   16.93062 1.413391          ?        ? 
1 1 1    3    5   23 o 9.870334 4.118023   9.005084    12.7  0.4510822 1.353247          ?        ? 
1 1 1    3    5   24 o 20.18781 3.277161   22.36868    96.6   4.450677 1.323174          ?        ? 
1 1 1    3    5   25 o 16.20003 5.038857   18.28829   154.9   3.638730 1.804329          ?        ? 
1 1 1    3    6    0 o 406.5744 4.154090   599.5601    -0.0   1654.118 33.77102   1654.118 33.77102 
1 1 1    3    6    1 o 515.4996 3.310564   676.2425   318.7   2658.528 34.13189          ?        ? 
1 1 1    3    6    2 o 419.9610 2.939467   480.5759    94.1   1764.243 24.68923          ?        ? 
1 1 1    3    6    3 o 251.2560 1.867121   237.7605   270.2   631.3948 9.382509          ?        ? 
1 1 1    3    6    4 o 83.20004 0.8313209   165.9359    17.3   69.22607 1.383319          ?        ? 
1 1 1    3    6    5 o 221.1548 1.822102   478.0942   214.2   489.2437 8.059335          ?        ? 
1 1 1    3    6    6 o 235.1463 1.905516   265.6272   218.0   553.0869 8.961499          ?        ? 
1 1 1    3    6    7 o 448.7381 3.705925   574.1251    24.9   2015.104 33.25979          ?        ? 
1 1 1    3    6    8 o 379.0392 2.883930   509.3864   352.3   1437.118 21.86245          ?        ? 
1 1 1    3    6    9 o 597.5137 4.376089   644.9323    13.7   3573.202 52.29546          ?        ? 
1 1 1    3    6   10 o 99.14563 1.152589   135.4899    39.1   98.30584 2.285483          ?        ? 
1 1 1    3    6   11 o 270.5680 2.206218   316.5059   100.2   732.3770 11.93864          ?        ? 
1 1 1    3    6   12 o 150.8950 1.285433   171.7517    28.7   227.7363 3.879307          ?        ? 
1 1 1    3    6   13 o 218.7124 1.677454   269.6257   278.2   478.5982 7.337603          ?        ? 
1 1 1    3    6   14 o 101.3095 1.068604   111.7384    85.8   102.6663 2.165194          ?        ? 
1 1 1    3    6   15 o 136.8908 1.208239   158.1178     6.7   187.4998 3.307936          ?        ? 
1 1 1    3    6   16 o 110.5871 1.087727   101.6330   235.7   122.3636 2.405771          ?        ? 
1 1 1    3    6   17 o 53.51608 1.095758   45.55976   156.7   28.65875 1.172814          ?        ? 
1 1 1    3    6   18 o 28.36269 1.590407   30.50018   280.4   8.059335 0.9021643          ?        ? 
1 1 1    3    6   19 o 57.03196 1.080936   63.92277   219.5   32.56813 1.232958          ?        ? 
1 1 1    3    6   20 o 7.851031 3.457972   6.037447   257.4 -0.2706493 1.052525          ?        ? 
1 1 1    3    6   21 o 43.61415 1.413484   49.56218   132.5   19.12588 1.232958          ?        ? 
1 1 1    3    6   22 o 29.58111 2.134859   17.49426   281.0   8.901355 1.263030          ?        ? 
1 1 1    3    6   23 o 27.58393 2.507472   24.24715   102.0   7.908974 1.383319          ?        ? 
1 1 1    3    6   24 f 37.52664 1.963319   37.45964   350.0   14.55492 1.473535          ?        ? 
1 1 1    3    6   25 o 39.88058 2.450678   37.56236   277.7   17.14112 1.954689          ?        ? 
1 1 1    3    7    0 o 379.2134 3.390743   1.262784   180.0   1438.682 25.71168   1438.682 25.71168 
1 1 1    3    7    1 o 396.1363 2.622816   747.7832   149.1   1569.646 20.77985          ?        ? 
1 1 1    3    7    2 o 128.0291 1.139194   151.6025   280.7   163.9232 2.916998          ?        ? 
1 1 1    3    7    3 o 157.3784 1.308910   209.0303   119.1   247.7043 4.119884          ?        ? 
1 1 1    3    7    4 o 196.3810 1.531316   61.67013   173.4   385.7354 6.014429          ?        ? 
1 1 1    3    7    5 o 174.1049 1.537246   352.9247     6.9   303.1874 5.352841          ?        ? 
1 1 1    3    7    6 o 237.7091 1.941901   368.1842   130.7   565.2059 9.232149          ?        ? 
1 1 1    3    7    7 o 58.18935 0.9043967   117.3538    63.7   33.86123 1.052525          ?        ? 
1 1 1    3    7    8 f 294.6198 2.597707   388.2737    78.9   868.2129 15.30672          ?        ? 
1 1 1    3    7    9 o 190.3567 1.635071   171.9673   101.7   362.3994 6.224934          ?        ? 
1 1 1    3    7   10 o 225.2593 1.922402   244.7322   253.4   507.5276 8.660777          ?        ? 
1 1 1    3    7   11 o 211.6111 1.783486   235.6645   249.1   447.9246 7.548109          ?        ? 
1 1 1    3    7   12 o 97.61262 1.170690   36.41668   116.1   95.29862 2.285483          ?        ? 
1 1 1    3    7   13 o 190.9113 1.504306   224.7820   185.0   364.6248 5.743780          ?        ? 
1 1 1    3    7   14 o 106.3880 1.102393   131.0116   105.0   113.2216 2.345627          ?        ? 
1 1 1    3    7   15 o 101.4763 1.096482   95.22660   302.6   103.0272 2.225339          ?        ? 
1 1 1    3    7   16 o 35.14081 1.369218   31.77156   306.1   12.35965 0.9623086          ?        ? 
1 1 1    3    7   17 o 20.26711 2.299876   17.05927    81.4   4.119884 0.9322364          ?        ? 
1 1 1    3    7   18 o 36.92256 1.384591   48.83499   200.0   13.65275 1.022453          ?        ? 
1 1 1    3    7   19 o 30.33367 1.685344   38.71650   292.2   9.232149 1.022453          ?        ? 
1 1 1    3    7   20 o 37.79650 1.551485   43.78939    31.9   14.34441 1.172814          ?        ? 
1 1 1    3    7   21 o 42.70466 1.443587   35.13040   302.5   18.34401 1.232958          ?        ? 
1 1 1    3    7   22 o 17.02942 3.638331   22.38307   290.5   3.157575 1.202886          ?        ? 
1 1 1    3    7   23 o 29.77175 2.575729   33.93084   195.3   9.232149 1.533679          ?        ? 
1 1 1    3    7   24 o 29.39876 2.557263   38.12884   197.4   9.141932 1.503607          ?        ? 
1 1 1    3    8    0 o 615.2849 6.196338   629.4282   180.0   3789.902 76.23289   3789.902 76.23289 
1 1 1    3    8    1 o 404.6836 2.548842   649.6459   175.9   1638.150 20.62949          ?        ? 
1 1 1    3    8    2 o 224.1906 1.636465   285.4708   192.7   502.6860 7.337603          ?        ? 
1 1 1    3    8    3 o 385.9526 2.746563   483.1885   135.6   1490.466 21.20086          ?        ? 
1 1 1    3    8    4 o 165.6925 1.379352   273.6804     6.1   274.5887 4.570966          ?        ? 
1 1 1    3    8    5 o 188.3185 1.485096   105.9717   164.3   354.7010 5.593419          ?        ? 
1 1 1    3    8    6 o 180.7603 1.555511   289.2284    63.1   326.7940 5.623491          ?        ? 
1 1 1    3    8    7 o 608.5543 4.442473   616.5160   235.9   3706.181 54.06972          ?        ? 
1 1 1    3    8    8 o 280.1048 2.458552   283.3563    17.6   784.7627 13.77304          ?        ? 
1 1 1    3    8    9 o 235.8108 2.161576   278.6908   144.1   556.1843 10.19446          ?        ? 
1 1 1    3    8   10 o 291.7443 2.329542   277.2445    75.9   851.4327 13.59261          ?        ? 
1 1 1    3    8   11 o 104.5456 1.164968   76.03282    18.5   109.3122 2.435844          ?        ? 
1 1 1    3    8   12 o 102.0837 1.148875   111.7777   188.5   104.2301 2.345627          ?        ? 
1 1 1    3    8   13 o 118.1209 1.196563   107.9716    55.0   139.5648 2.826782          ?        ? 
1 1 1    3    8   14 o 92.48239 0.9917567   49.38724   143.3   85.55525 1.834401          ?        ? 
1 1 1    3    8   15 o 79.09139 0.9885725   79.28735    98.8   62.58014 1.563751          ?        ? 
1 1 1    3    8   16 o 24.50370 1.840873   38.41184    43.0   6.014429 0.9021643          ?        ? 
1 1 1    3    8   17 o 127.7284 1.224278   131.3087    24.8   163.2917 3.127503          ?        ? 
1 1 1    3    8   18 o 49.93355 1.144262   46.88991   299.1   24.95988 1.142741          ?        ? 
1 1 1    3    8   19 o 36.57883 1.397602   26.01194   252.7   13.41218 1.022453          ?        ? 
1 1 1    3    8   20 o 99.09953 1.213816   107.5101     1.9   98.48627 2.405771          ?        ? 
1 1 1    3    8   21 o 57.53893 1.384996   66.96773   137.1   33.28986 1.593824          ?        ? 
1 1 1    3    8   22 o 20.88318 2.520030   29.33389   123.5   4.480750 1.052525          ?        ? 
1 1 1    3    8   23 o 55.04060 1.420543   51.03310    93.2   30.67359 1.563751          ?        ? 
1 1 1    3    8   24 o 31.24805 2.502158   26.69603   168.6   10.31474 1.563751          ?        ? 
1 1 1    3    9    0 o 340.3457 3.181500   524.3908   180.0   1158.980 21.65195   1158.980 21.65195 
1 1 1    3    9    1 o 93.20663 0.8388629   157.2970   138.0   86.87843 1.563751          ?        ? 
1 1 1    3    9    2 o 136.4180 1.124250   142.2450    45.0   186.1165 3.067359          ?        ? 
1 1 1    3    9    3 o 228.8327 1.780679   313.0462    25.6   523.7966 8.149551          ?        ? 
1 1 1    3    9    4 o 83.99053 0.9130073   181.8401    21.2   70.54926 1.533679          ?        ? 
1 1 1    3    9    5 o 172.1478 1.397503   196.2980   319.8   296.3911 4.811543          ?        ? 
1 1 1    3    9    6 o 93.86478 1.057245   198.7106    21.6   88.11138 1.984761          ?        ? 
1 1 1    3    9    7 o 314.2176 2.478755   347.8107   245.8   987.5391 15.57737          ?        ? 
1 1 1    3    9    8 o 435.4122 3.308258   521.4014   285.1   1896.680 28.80912          ?        ? 
1 1 1    3    9    9 o 253.0442 2.299582   185.8920   119.4   640.4766 11.63792          ?        ? 
1 1 1    3    9   10 o 365.1550 3.104763   363.5562    14.4   1334.241 22.67440          ?        ? 
1 1 1    3    9   11 o 181.8456 1.595838   205.0455    47.2   330.7635 5.803924          ?        ? 
1 1 1    3    9   12 o 214.3618 1.788657   244.6001   328.4   459.7430 7.668397          ?        ? 
1 1 1    3    9   13 o 80.11761 1.050980   72.15193   106.5   64.20403 1.684040          ?        ? 
1 1 1    3    9   14 o 126.3207 1.273631   175.7334   234.8   159.6530 3.217719          ?        ? 
1 1 1    3    9   15 f 91.04929 1.089938   92.02045   110.2   82.93897 1.984761          ?        ? 
1 1 1    3    9   16 o 69.06364 1.001481   69.98962   156.6   47.72449 1.383319          ?        ? 
1 1 1    3    9   17 o 32.78882 1.467434   32.12004   309.9   10.76583 0.9623086          ?        ? 
1 1 1    3    9   18 o 79.63493 1.095113   79.40074   137.8   63.48230 1.744184          ?        ? 
1 1 1    3    9   19 o 86.24409 1.098362   68.80064   286.1   74.48870 1.894545          ?        ? 
1 1 1    3    9   20 o 53.10357 1.274158   48.13747    68.2   28.29789 1.353247          ?        ? 
1 1 1    3    9   21 o 30.51887 2.167797   38.55160    19.6   9.442654 1.323174          ?        ? 
1 1 1    3    9   22 o 38.87669 1.508377   35.03515   212.8   15.27665 1.172814          ?        ? 
1 1 1    3    9   23 o 22.09040 2.382313   21.24554   283.9   5.052120 1.052525          ?        ? 
1 1 1    3    9   24 o 15.46138 4.374450   6.897293   233.5   2.916998 1.413391          ?        ? 
1 1 1    3   10    0 o 254.1142 2.538985   129.1281   180.0   646.1000 12.90095   646.1000 12.90095 
1 1 1    3   10    1 o 127.5797 1.037136   136.2420   283.7   162.7805 2.646349          ?        ? 
1 1 1    3   10    2 f 306.3431 2.130179   250.5781    18.0   938.8524 13.05131          ?        ? 
1 1 1    3   10    3 o 34.85487 0.6902253   194.4852   124.9   12.14915 0.4811543          ?        ? 
1 1 1    3   10    4 o 35.58060 0.7606652   187.0130    70.1   12.66037 0.5412986          ?        ? 
1 1 1    3   10    5 o 265.8081 1.979859   409.0168    38.0   706.7255 10.52525          ?        ? 
1 1 1    3   10    6 o 93.20638 1.048581   144.0741   105.5   86.87843 1.954689          ?        ? 
1 1 1    3   10    7 o 260.5259 2.175829   345.5817   185.0   678.8486 11.33720          ?        ? 
1 1 1    3   10    8 o 144.3547 1.374920   102.8261    16.5   208.4000 3.969523          ?        ? 
1 1 1    3   10    9 o 170.1992 1.554854   151.3511   134.3   289.7151 5.292697          ?        ? 
1 1 1    3   10   10 o 285.5312 2.611936   338.1447   247.9   815.7069 14.91578          ?        ? 
1 1 1    3   10   11 o 314.2677 2.717584   327.3972   296.9   988.4113 17.08098          ?        ? 
1 1 1    3   10   12 o 103.2381 1.150592   103.1193   200.7   106.6058 2.375700          ?        ? 
1 1 1    3   10   13 o 169.2381 1.554799   194.5658   120.4   286.5875 5.262625          ?        ? 
1 1 1    3   10   14 o 51.69434 1.134373   32.21119    88.3   26.73414 1.172814          ?        ? 
1 1 1    3   10   15 o 78.02041 0.9828707   65.39624   354.9   60.89609 1.533679          ?        ? 
1 1 1    3   10   16 o 46.44910 1.132987   67.23345   250.2   21.59180 1.052525          ?        ? 
1 1 1    3   10   17 o 30.79865 1.659899   23.94297   208.3   9.502798 1.022453          ?        ? 
1 1 1    3   10   18 o 65.33804 1.035573   59.18645   249.9   42.73252 1.353247          ?        ? 
1 1 1    3   10   19 o 107.5401 1.160492   114.7461   248.2   115.8379 2.495988          ?        ? 
1 1 1    3   10   20 o 51.14277 1.293609   55.07394   282.2   26.25298 1.323174          ?        ? 
1 1 1    3   10   21 o 25.87698 2.208027   28.57059   271.2   6.796305 1.142741          ?        ? 
1 1 1    3   10   22 o 17.65771 3.443826   15.80777   111.8   3.398152 1.172814          ?        ? 
1 1 1    3   10   23 o 35.41646 1.825567   41.19135   293.3   12.81073 1.293102          ?        ? 
1 1 1    3   10   24 o 7.529719 3.479056   11.34177     7.6 -0.6615872 1.232958          ?        ? 
1 1 1    3   11    0 o 193.4584 2.036836   205.3526   360.0   374.4583 7.878902   374.4583 7.878902 
1 1 1    3   11    1 o 234.3595 1.680944   518.9708   298.2   549.3880 7.878902          ?        ? 
1 1 1    3   11    2 o 180.1436 1.327127   265.7874   236.0   324.5687 4.781471          ?        ? 
1 1 1    3   11    3 o 247.0085 1.753134   316.1609   257.3   610.2841 8.660777          ?        ? 
1 1 1    3   11    4 o 265.3757 1.824438   225.7467   273.3   704.4099 9.683230          ?        ? 
1 1 1    3   11    5 o 438.4995 3.075797   571.6157    98.8   1923.835 26.97471          ?        ? 
1 1 1    3   11    6 o 287.2941 2.323757   251.8478    78.5   825.5405 13.35203          ?        ? 
1 1 1    3   11    7 o 212.3526 1.826824   256.7443   316.3   450.9919 7.758613          ?        ? 
1 1 1    3   11    8 o 148.0155 1.422182   178.7515   310.8   219.1056 4.210100          ?        ? 
1 1 1    3   11    9 o 341.2438 2.679003   337.5686   201.8   1164.965 18.28386          ?        ? 
1 1 1    3   11   10 o 286.2446 2.269242   342.4803   198.2   819.7366 12.99117          ?        ? 
1 1 1    3   11   11 o 317.8861 2.838011   341.4630   165.3   1011.446 18.04329          ?        ? 
1 1 1    3   11   12 o 344.3146 3.013201   351.4461   210.3   1187.489 20.74978          ?        ? 
1 1 1    3   11   13 o 109.4652 1.167555   112.2699   225.8   119.8676 2.556132          ?        ? 
1 1 1    3   11   14 o 50.99055 1.179518   54.22339   234.9   26.01241 1.202886          ?        ? 
1 1 1    3   11   15 o 60.60019 1.190972   74.96664   227.2   36.74816 1.443463          ?        ? 
1 1 1    3   11   16 o 38.79559 1.317744   64.82446   288.1   15.06614 1.022453          ?        ? 
1 1 1    3   11   17 f 59.13861 1.144131   46.55989    64.8   35.00398 1.353247          ?        ? 
1 1 1    3   11   18 f 65.00890 1.110204   58.99592   240.2   42.31151 1.443463          ?        ? 
1 1 1    3   11   19 o 13.30723 3.549300   23.25599   254.4   1.864473 0.9623086          ?        ? 
1 1 1    3   11   20 o 43.82988 1.234999   42.50518   264.2   19.27625 1.082597          ?        ? 
1 1 1    3   11   21 o 23.39382 2.249579   14.66010    41.0   5.563347 1.052525          ?        ? 
1 1 1    3   11   22 o 21.76439 2.348912   17.16880   173.2   4.871688 1.022453          ?        ? 
1 1 1    3   11   23 f 14.05362 3.987580   10.76989   194.0   2.255411 1.172814          ?        ? 
1 1 1    3   11   24 o 16.67364 4.010841   20.73554   325.3   3.368080 1.323174          ?        ? 
1 1 1    3   12    0 o 121.0566 1.528292   198.7820     0.0   146.6318 3.698874   146.6318 3.698874 
1 1 1    3   12    1 o 120.5512 1.022767   194.7798   164.1   145.3387 2.465916          ?        ? 
1 1 1    3   12    2 o 92.62331 0.8603793   76.08904    78.2   85.79582 1.593824          ?        ? 
1 1 1    3   12    3 o 194.2384 1.478539   338.1384    37.3   377.3453 5.743780          ?        ? 
1 1 1    3   12    4 o 475.2450 3.049959   648.3581   279.7   2259.892 28.98955          ?        ? 
1 1 1    3   12    5 o 131.4361 1.166863   121.1044   130.3   172.7645 3.067359          ?        ? 
1 1 1    3   12    6 o 866.3128 6.213592   866.6818   193.8   7514.938 107.6583          ?        ? 
1 1 1    3   12    7 o 304.4317 2.523861   265.0044    59.1   927.0340 15.36687          ?        ? 
1 1 1    3   12    8 o 218.9355 1.895515   259.4487    40.6   479.4101 8.299912          ?        ? 
1 1 1    3   12    9 o 240.4525 1.969771   297.1194    44.6   578.3174 9.472726          ?        ? 
1 1 1    3   12   10 o 220.0618 1.837985   249.8156    10.1   484.4322 8.089407          ?        ? 
1 1 1    3   12   11 o 90.54987 1.129160   127.2515   337.9   82.00674 2.044906          ?        ? 
1 1 1    3   12   12 o 196.8061 1.719010   207.6275   149.9   387.5397 6.766232          ?        ? 
1 1 1    3   12   13 o 67.35145 1.183214   59.30857   242.2   45.37886 1.593824          ?        ? 
1 1 1    3   12   14 o 99.45438 1.194366   101.5489    13.6   98.96743 2.375700          ?        ? 
1 1 1    3   12   15 o 79.67088 1.113491   77.97294    99.6   63.51237 1.774257          ?        ? 
1 1 1    3   12   16 o 91.64995 1.082795   109.5170    57.2   84.05164 1.984761          ?        ? 
1 1 1    3   12   17 o 88.67567 1.102157   125.4711   204.3   78.69881 1.954689          ?        ? 
1 1 1    3   12   18 o 86.95232 1.072124   103.9741   129.9   75.69159 1.864473          ?        ? 
1 1 1    3   12   19 o 33.05888 1.682860   26.70834   105.3   10.97633 1.112669          ?        ? 
1 1 1    3   12   20 o 15.50876 3.298266   20.39284   177.0   2.556132 0.9923807          ?        ? 
1 1 1    3   12   21 o 22.59379 2.329235   27.15932   171.0   5.202481 1.052525          ?        ? 
1 1 1    3   12   22 o 11.38096 4.157197   18.20020    97.1   1.232958 1.232958          ?        ? 
1 1 1    3   12   23 o 25.92929 2.551506   24.69973   332.3   7.036882 1.323174          ?        ? 
1 1 1    3   12   24 o 17.77467 3.912374   12.83074   241.7   3.819162 1.353247          ?        ? 
1 1 1    3   13    0 o 679.6086 5.755537   682.9885     0.0   4625.427 78.21765   4625.427 78.21765 
1 1 1    3   13    1 o 128.2616 1.090237   221.1903   211.2   164.5247 2.796710          ?        ? 
1 1 1    3   13    2 o 208.2238 1.501992   209.6083    43.8   433.6403 6.255006          ?        ? 
1 1 1    3   13    3 o 318.3664 2.200863   406.5466   130.9   1013.882 14.01362          ?        ? 
1 1 1    3   13    4 o 219.1199 1.585129   174.1528   207.6   480.1920 6.946666          ?        ? 
1 1 1    3   13    5 o 477.7495 3.056000   507.5334   105.4   2283.198 29.20005          ?        ? 
1 1 1    3   13    6 o 359.3409 2.422738   453.2027   259.8   1291.538 17.41177          ?        ? 
1 1 1    3   13    7 o 126.4085 1.320326   97.16492   186.6   159.8034 3.338008          ?        ? 
1 1 1    3   13    8 o 41.14519 1.205950   48.22132   346.2   16.93062 0.9923807          ?        ? 
1 1 1    3   13    9 o 52.45312 1.146629   107.7692    67.3   27.51601 1.202886          ?        ? 
1 1 1    3   13   10 o 299.0597 2.443503   324.5023   191.5   894.9169 14.61506          ?        ? 
1 1 1    3   13   11 f 380.2251 2.957980   363.0595    36.6   1447.733 22.49397          ?        ? 
1 1 1    3   13   12 o 65.91148 1.095001   27.97440   150.9   43.45425 1.443463          ?        ? 
1 1 1    3   13   13 o 42.78428 1.265181   47.15292    37.7   18.31394 1.082597          ?        ? 
1 1 1    3   13   14 o 61.16924 1.204474   93.80579   326.1   37.43982 1.473535          ?        ? 
1 1 1    3   13   15 o 86.03554 1.153455   83.98164    27.2   74.06770 1.984761          ?        ? 
1 1 1    3   13   16 o 69.42627 1.147854   65.45764   148.5   48.23572 1.593824          ?        ? 
1 1 1    3   13   17 o 79.52484 1.134444   79.56305   151.8   63.30186 1.804329          ?        ? 
1 1 1    3   13   18 o 56.63108 1.168240   51.35809    84.9   32.11705 1.323174          ?        ? 
1 1 1    3   13   19 o 57.34633 1.206109   64.88757   194.9   32.95907 1.383319          ?        ? 
1 1 1    3   13   20 o 45.41858 1.324222   46.54597    90.7   20.71971 1.202886          ?        ? 
1 1 1    3   13   21 o 34.95716 1.763527   36.01154   236.5   12.35965 1.232958          ?        ? 
1 1 1    3   13   22 o 16.56952 3.799556   19.46354   332.5   3.067359 1.232958          ?        ? 
1 1 1    3   13   23 o 30.25756 2.385293   25.79144    72.4   9.562942 1.443463          ?        ? 
1 1 1    3   13   24 o 17.56670 3.948140   15.84584   355.0   3.759018 1.353247          ?        ? 
1 1 1    3   14    0 o 57.77083 1.067926   21.72392   180.0   33.41015 1.232958   33.41015 1.232958 
1 1 1    3   14    1 o 182.5178 1.392246   269.6493    74.5   333.1693 5.082192          ?        ? 
1 1 1    3   14    2 o 74.34426 0.7685472   145.0206   325.4   55.27260 1.142741          ?        ? 
1 1 1    3   14    3 o 65.16199 0.7153222   75.34607    51.5   42.46187 0.9322364          ?        ? 
1 1 1    3   14    4 o 306.7841 2.117314   354.9287    51.1   941.3182 12.99117          ?        ? 
1 1 1    3   14    5 o 509.6630 3.271771   420.9018    80.8   2598.534 33.35001          ?        ? 
1 1 1    3   14    6 o 327.6793 2.243852   323.3176    67.1   1073.967 14.70528          ?        ? 
1 1 1    3   14    7 o 227.3691 1.964081   281.3998    12.1   517.0605 8.931427          ?        ? 
1 1 1    3   14    8 o 111.5871 1.253151   204.3961   174.4   124.5288 2.796710          ?        ? 
1 1 1    3   14    9 o 166.5203 1.607264   134.1102   219.7   277.3554 5.352841          ?        ? 
1 1 1    3   14   10 o 348.0485 2.730309   380.2543   311.5   1212.389 19.00560          ?        ? 
1 1 1    3   14   11 f 59.07893 1.297992   46.20224   263.8   34.91376 1.533679          ?        ? 
1 1 1    3   14   12 o 13.90112 3.200850   32.03748   261.7   2.014834 0.8720922          ?        ? 
1 1 1    3   14   13 o 172.9271 1.573801   205.0264   326.4   299.2780 5.443058          ?        ? 
1 1 1    3   14   14 o 51.45864 1.139569   56.60490   274.8   26.49356 1.172814          ?        ? 
1 1 1    3   14   15 o 94.44488 1.066672   94.76842   270.3   89.25412 2.014834          ?        ? 
1 1 1    3   14   16 o 88.78796 1.253176   104.8884   113.0   78.90931 2.225339          ?        ? 
1 1 1    3   14   17 o 116.5835 1.315520   153.9600   301.9   136.1065 3.067359          ?        ? 
1 1 1    3   14   18 o 43.95988 1.333959   46.00045   247.8   19.36646 1.172814          ?        ? 
1 1 1    3   14   19 o 16.22906 3.170505   32.43361   183.3   2.766637 0.9923807          ?        ? 
1 1 1    3   14   20 o 27.53630 2.020368   37.14040   101.4   7.668397 1.112669          ?        ? 
1 1 1    3   14   21 o 30.58791 1.818806   41.79977   168.3   9.472726 1.112669          ?        ? 
1 1 1    3   14   22 o 30.28184 1.936497   27.63441   334.6   9.382509 1.172814          ?        ? 
1 1 1    3   14   23 o 40.97532 1.761381   27.43822   201.2   17.23134 1.443463          ?        ? 
1 1 1    3   14   24 o 8.507856 3.762485   7.975601    56.2       0.06 1.263030          ?        ? 
1 1 1    3   15    0 o 92.07826 1.241560   303.3390   180.0   84.83352 2.285483   84.83352 2.285483 
1 1 1    3   15    1 o 277.5358 1.869109   254.8575   333.9   770.3882 10.37489          ?        ? 
1 1 1    3   15    2 o 132.0414 1.115965   106.7627   286.9   174.3583 2.947070          ?        ? 
1 1 1    3   15    3 o 211.9177 1.504192   223.0424   284.6   449.1275 6.375295          ?        ? 
1 1 1    3   15    4 o 215.6160 1.631809   257.0836    82.2   464.9454 7.036882          ?        ? 
1 1 1    3   15    5 o 121.1386 1.055045   99.26678   310.1   146.7521 2.556132          ?        ? 
1 1 1    3   15    6 o 301.6650 2.083463   329.2462   214.5   910.1936 12.57016          ?        ? 
1 1 1    3   15    7 o 266.0324 1.870802   256.1781   275.0   707.8682 9.953879          ?        ? 
1 1 1    3   15    8 o 389.9771 3.065225   381.7952   162.4   1521.831 23.90735          ?        ? 
1 1 1    3   15    9 o 172.0500 1.625521   171.8371   207.3   296.0903 5.593419          ?        ? 
1 1 1    3   15   10 o 92.69788 1.216539   111.9795   238.4   85.94618 2.255411          ?        ? 
1 1 1    3   15   11 o 118.9198 1.239100   106.2332   195.5   141.4594 2.947070          ?        ? 
1 1 1    3   15   12 o 176.4636 1.644510   220.2408   122.4   311.6075 5.803924          ?        ? 
1 1 1    3   15   13 o 49.82830 1.146679   48.38736   118.3   24.83959 1.142741          ?        ? 
1 1 1    3   15   14 o 65.64973 1.122271   107.6634    96.3   43.12346 1.473535          ?        ? 
1 1 1    3   15   15 o 5.709857 2.760694   24.54582    12.1  -1.563751 0.9623086          ?        ? 
1 1 1    3   15   16 o 84.58505 1.084353   88.23486   109.2   71.60178 1.834401          ?        ? 
1 1 1    3   15   17 o 94.53185 1.129314   101.9930   165.7   89.46463 2.135122          ?        ? 
1 1 1    3   15   18 o 89.88969 1.254544   99.47565    61.9   80.95422 2.255411          ?        ? 
1 1 1    3   15   19 o 9.585630 3.800724   19.54238    23.4  0.5412986 1.082597          ?        ? 
1 1 1    3   15   20 o 22.32729 2.155005   33.58789   157.6   5.052120 0.9623086          ?        ? 
1 1 1    3   15   21 o 7.533006 3.332752   11.07648   179.9 -0.2405772 0.9923807          ?        ? 
1 1 1    3   15   22 o 13.47642 3.903616   9.731937   191.9   2.044906 1.112669          ?        ? 
1 1 1    3   15   23 o 9.037972 3.832001   9.138442   173.1  0.3307936 1.202886          ?        ? 
1 1 1    3   15   24 o 11.04209 4.175124   6.338066     8.3   1.383319 1.263030          ?        ? 
1 1 1    3   16    0 o 393.0017 3.600903   454.6632   180.0   1545.257 28.29789   1545.257 28.29789 
1 1 1    3   16    1 o 340.4202 2.261461   427.6058    42.7   1159.071 15.39694          ?        ? 
1 1 1    3   16    2 o 295.3836 1.985238   313.3609    84.3   872.6335 11.72814          ?        ? 
1 1 1    3   16    3 o 63.83329 0.7773222   89.02505   358.2   40.74776 0.9923807          ?        ? 
1 1 1    3   16    4 o 487.5965 3.157721   477.1127    28.5   2378.436 30.79388          ?        ? 
1 1 1    3   16    5 o 352.3556 2.398223   317.9068   267.7   1241.859 16.90055          ?        ? 
1 1 1    3   16    6 o 341.9610 2.326020   369.3010   202.6   1169.686 15.90816          ?        ? 
1 1 1    3   16    7 o 190.6705 1.490434   213.1840   280.1   363.6023 5.683635          ?        ? 
1 1 1    3   16    8 o 108.1929 1.153490   143.6400   225.3   117.0709 2.495988          ?        ? 
1 1 1    3   16    9 o 47.95906 1.348131   59.10912   195.3   23.00519 1.293102          ?        ? 
1 1 1    3   16   10 f 116.5450 1.303053   126.4653     1.3   135.8660 3.037287          ?        ? 
1 1 1    3   16   11 o 74.57813 1.108883   72.55820    21.4   55.63347 1.653968          ?        ? 
1 1 1    3   16   12 o 53.49379 1.236755   45.90162    26.2   28.62868 1.323174          ?        ? 
1 1 1    3   16   13 o 147.1402 1.471518   141.2493   256.9   216.6999 4.330389          ?        ? 
1 1 1    3   16   14 o 73.53109 1.104224   81.56182   193.3   54.09978 1.623896          ?        ? 
1 1 1    3   16   15 o 145.6898 1.496488   122.1795   240.8   212.5199 4.360461          ?        ? 
1 1 1    3   16   16 o 68.76510 1.224487   68.35724   346.9   47.33355 1.684040          ?        ? 
1 1 1    3   16   17 o 61.39751 1.102037   67.45805   123.8   37.74054 1.353247          ?        ? 
1 1 1    3   16   18 o 50.08487 1.290911   48.44007   245.2   25.14031 1.293102          ?        ? 
1 1 1    3   16   19 o 43.48594 1.244767   35.58368    15.2   18.97552 1.082597          ?        ? 
1 1 1    3   16   20 f 12.54254 3.394057   9.770416   185.9   1.684040 0.8720922          ?        ? 
1 1 1    3   16   21 o 48.33031 1.275553   48.16890   279.3   23.54649 1.232958          ?        ? 
1 1 1    3   16   22 o 50.93458 1.239855   50.90088   280.5   26.19284 1.263030          ?        ? 
1 1 1    3   16   23 o 36.72388 1.514913   36.63784   244.8   13.77304 1.112669          ?        ? 
1 1 1    3   17    0 o 47.57148 1.202783   112.6311     0.0   22.67440 1.142741   22.67440 1.142741 
1 1 1    3   17    1 o 454.2943 2.849707   438.4315   281.3   2064.423 25.89212          ?        ? 
1 1 1    3   17    2 o 428.0101 2.694485   479.3272    47.5   1832.416 23.06533          ?        ? 
1 1 1    3   17    3 o 395.1129 2.458362   385.6200    15.0   1561.526 19.42661          ?        ? 
1 1 1    3   17    4 o 161.1562 1.324878   137.8174    59.2   259.7331 4.270245          ?        ? 
1 1 1    3   17    5 o 265.2137 1.933271   293.4142   161.8   703.5078 10.25460          ?        ? 
1 1 1    3   17    6 o 303.2702 2.107141   335.6435    44.7   919.9670 12.78066          ?        ? 
1 1 1    3   17    7 o 313.3634 2.154431   340.0197   132.6   982.3066 13.50239          ?        ? 
1 1 1    3   17    8 o 195.1144 1.679970   162.0409   108.3   380.8036 6.555727          ?        ? 
1 1 1    3   17    9 o 367.0989 2.682827   395.1014   222.9   1348.856 19.69725          ?        ? 
1 1 1    3   17   10 o 116.1734 1.126022   117.2965    38.9   134.9939 2.616277          ?        ? 
1 1 1    3   17   11 o 140.2884 1.446927   129.1889    66.4   196.9124 4.059740          ?        ? 
1 1 1    3   17   12 o 186.2433 1.679257   204.1919    41.1   347.1829 6.255006          ?        ? 
1 1 1    3   17   13 o 68.34364 1.122035   84.88599   109.4   46.73211 1.533679          ?        ? 
1 1 1    3   17   14 o 42.77594 1.335729   39.95055    72.1   18.31394 1.142741          ?        ? 
1 1 1    3   17   15 o 128.4099 1.370004   115.5483   187.7   165.0660 3.518441          ?        ? 
1 1 1    3   17   16 f 44.98857 1.403723   17.52884   212.8   20.26863 1.263030          ?        ? 
1 1 1    3   17   17 o 53.52291 1.207989   61.30901   193.7   28.68883 1.293102          ?        ? 
1 1 1    3   17   18 o 73.68527 1.122319   64.07204   263.7   54.40051 1.653968          ?        ? 
1 1 1    3   17   19 o 23.51476 2.238010   25.13001    20.2   5.593419 1.052525          ?        ? 
1 1 1    3   17   20 o 37.62889 1.398560   46.79495   325.4   14.25420 1.052525          ?        ? 
1 1 1    3   17   21 o 33.36744 1.577174   32.26809   196.1   11.27705 1.052525          ?        ? 
1 1 1    3   17   22 o 20.45929 2.498750   11.93881   176.1   4.360461 1.022453          ?        ? 
1 1 1    3   17   23 o 15.05198 3.549767   17.11526   311.2   2.646349 1.052525          ?        ? 
1 1 1    3   18    0 o 743.5702 6.152314   851.9109   180.0   5534.387 91.47947   5534.387 91.47947 
1 1 1    3   18    1 o 545.9899 3.373540   610.0825   159.2   2982.465 36.83838          ?        ? 
1 1 1    3   18    2 o 272.5976 1.836778   302.4165   210.1   743.2029 10.01402          ?        ? 
1 1 1    3   18    3 o 595.8665 3.565559   629.9961    38.3   3552.573 42.49194          ?        ? 
1 1 1    3   18    4 o 38.07097 1.066361   65.40967   221.5   14.49477 0.8119479          ?        ? 
1 1 1    3   18    5 o 270.9509 1.942280   282.9340   113.6   734.3016 10.52525          ?        ? 
1 1 1    3   18    6 o 442.5009 2.922259   420.4418     3.1   1959.200 25.86205          ?        ? 
1 1 1    3   18    7 o 238.8162 1.762904   245.4889   164.7   570.4987 8.420200          ?        ? 
1 1 1    3   18    8 o 244.5444 1.906068   322.3835    99.0   598.2552 9.322365          ?        ? 
1 1 1    3   18    9 o 84.52079 1.085177   101.7234   262.2   71.45142 1.834401          ?        ? 
1 1 1    3   18   10 o 194.4576 1.639251   213.2594   338.4   378.3376 6.375295          ?        ? 
1 1 1    3   18   11 o 123.9990 1.236848   149.2063   335.5   153.8190 3.067359          ?        ? 
1 1 1    3   18   12 o 100.7015 1.254231   121.8367    56.0   101.4634 2.526060          ?        ? 
1 1 1    3   18   13 o 122.5229 1.349926   122.8021   161.6   150.2404 3.307936          ?        ? 
1 1 1    3   18   14 o 132.2531 1.387038   157.2155   258.6   175.1101 3.668802          ?        ? 
1 1 1    3   18   15 o 138.2836 1.500524   145.8638     2.0   191.4994 4.149956          ?        ? 
1 1 1    3   18   16 o 15.67755 3.934978   13.49595   229.2   2.586205 1.232958          ?        ? 
1 1 1    3   18   17 o 32.32928 1.860366   23.28568   148.9   10.49518 1.202886          ?        ? 
1 1 1    3   18   18 o 52.24280 1.295151   59.19559   300.8   27.36565 1.353247          ?        ? 
1 1 1    3   18   19 o 45.67416 1.349732   53.18875    36.5   20.96028 1.232958          ?        ? 
1 1 1    3   18   20 o 9.079792 3.501763   10.94401   223.1  0.6014429 0.9021643          ?        ? 
1 1 1    3   18   21 o 40.43933 1.450091   46.75247    65.8   16.53968 1.172814          ?        ? 
1 1 1    3   18   22 o 10.92386 3.754477   17.51656    74.2   1.263030 0.9923807          ?        ? 
1 1 1    3   18   23 o 18.15393 2.981716   17.37955   132.7   3.638730 1.082597          ?        ? 
1 1 1    3   19    0 o 699.3885 5.850767   718.6628     0.0   4896.196 81.82631   4896.196 81.82631 
1 1 1    3   19    1 f 404.1667 2.596745   354.0740   332.9   1634.000 20.99036          ?        ? 
1 1 1    3   19    2 o 327.2256 2.132088   273.8866     1.5   1070.989 13.95348          ?        ? 
1 1 1    3   19    3 o 66.23729 0.8172113   142.8343   200.6   43.87526 1.082597          ?        ? 
1 1 1    3   19    4 o 324.9777 2.100568   381.5326   125.2   1056.374 13.65275          ?        ? 
1 1 1    3   19    5 o 150.3324 1.270239   98.64275   231.1   226.0222 3.819162          ?        ? 
1 1 1    3   19    6 o 157.6313 1.344965   88.95186   202.5   248.5162 4.240172          ?        ? 
1 1 1    3   19    7 o 197.9397 1.564835   176.3409    48.2   391.9002 6.194862          ?        ? 
1 1 1    3   19    8 o 22.66935 2.188816   15.86029    93.4   5.142337 0.9923807          ?        ? 
1 1 1    3   19    9 o 94.81260 1.141828   114.4248    59.2   89.91571 2.165194          ?        ? 
1 1 1    3   19   10 o 87.58971 1.132988   99.36307   321.5   76.74411 1.984761          ?        ? 
1 1 1    3   19   11 o 146.1292 1.347934   144.2492    32.4   213.6626 3.939451          ?        ? 
1 1 1    3   19   12 o 54.54756 1.157733   75.74510    42.8   29.77142 1.263030          ?        ? 
1 1 1    3   19   13 o 127.8211 1.388078   147.4258   183.7   163.5323 3.548513          ?        ? 
1 1 1    3   19   14 o 57.30589 1.259437   76.27650   103.1   32.86885 1.443463          ?        ? 
1 1 1    3   19   15 o 43.25347 1.460033   52.31299   275.7   18.73495 1.263030          ?        ? 
1 1 1    3   19   16 o 99.93764 1.248773   99.21793    69.3   100.0200 2.495988          ?        ? 
1 1 1    3   19   17 o 24.26343 2.292894   34.74318   185.7   5.924213 1.112669          ?        ? 
1 1 1    3   19   18 o 18.59460 2.911052   20.12030   260.2   3.518441 1.082597          ?        ? 
1 1 1    3   19   19 o 8.169629 3.552808   8.642377    73.3 -0.1202886 1.082597          ?        ? 
1 1 1    3   19   20 o 43.69296 1.445347   52.24486   172.6   19.24617 1.263030          ?        ? 
1 1 1    3   19   21 o 42.89600 1.367043   33.72860   222.5   18.61466 1.172814          ?        ? 
1 1 1    3   19   22 o 18.25564 2.965103   14.46344    94.7   3.578585 1.082597          ?        ? 
1 1 1    3   19   23 o 30.18880 1.942465   34.07883   147.1   9.532870 1.172814          ?        ? 
1 1 1    3   20    0 o 502.0857 4.298134   502.3612    -0.0   2522.662 43.15353   2522.662 43.15353 
1 1 1    3   20    1 o 353.2775 2.349403   297.3333   313.6   1248.415 16.59982          ?        ? 
1 1 1    3   20    2 o 63.83260 0.8715525   78.22285   194.6   40.74776 1.112669          ?        ? 
1 1 1    3   20    3 o 440.1639 2.708901   437.3516   206.4   1938.300 23.84721          ?        ? 
1 1 1    3   20    4 o 119.6757 1.055377   101.6208   333.5   143.2336 2.526060          ?        ? 
1 1 1    3   20    5 o 289.1618 2.064353   303.2342   321.1   836.4567 11.93864          ?        ? 
1 1 1    3   20    6 o 146.8471 1.300388   191.6113   348.4   215.6774 3.819162          ?        ? 
1 1 1    3   20    7 o 57.82378 1.040131   39.85519   152.4   33.44022 1.202886          ?        ? 
1 1 1    3   20    8 o 98.45529 1.038495   103.1162   308.1   96.95259 2.044906          ?        ? 
1 1 1    3   20    9 o 189.9868 1.598683   150.5240   249.2   361.1364 6.074574          ?        ? 
1 1 1    3   20   10 o 54.22288 1.109205   60.95654   121.3   29.41056 1.202886          ?        ? 
1 1 1    3   20   11 o 179.9121 1.546129   176.7467   177.6   323.9371 5.563347          ?        ? 
1 1 1    3   20   12 o 78.82093 1.125498   85.71070   234.5   62.15912 1.774257          ?        ? 
1 1 1    3   20   13 o 31.71699 1.659245   24.43971   324.2   10.07417 1.052525          ?        ? 
1 1 1    3   20   14 o 80.93889 1.114624   52.49255   189.3   65.55727 1.804329          ?        ? 
1 1 1    3   20   15 o 62.91777 1.314389   64.28017   187.5   39.63509 1.653968          ?        ? 
1 1 1    3   20   16 o 7.621815 3.459940   17.54523   268.3 -0.6615872 1.142741          ?        ? 
1 1 1    3   20   17 o 23.41214 2.568936   9.060091   285.8   5.533275 1.202886          ?        ? 
1 1 1    3   20   18 o 35.49857 1.778987   28.93537    54.1   12.69044 1.263030          ?        ? 
1 1 1    3   20   19 o 43.95632 1.334067   45.49062   155.9   19.42661 1.172814          ?        ? 
1 1 1    3   20   20 f 72.55703 1.264110   63.94595    65.3   53.04726 1.834401          ?        ? 
1 1 1    3   20   21 o 22.93847 2.359786   26.04905   234.8   5.443058 1.082597          ?        ? 
1 1 1    3   20   22 o 14.12656 3.686557   10.73909   100.8   2.315555 1.052525          ?        ? 
1 1 1    3   20   23 o 12.64902 3.961456   7.853753    84.1   1.984761 1.112669          ?        ? 
1 1 1    3   21    0 o 315.2798 2.962211   302.4750     0.0   994.5460 18.67480   994.5460 18.67480 
1 1 1    3   21    1 o 43.66297 0.9986634   79.63329    67.6   19.06574 0.8720922          ?        ? 
1 1 1    3   21    2 o 219.0257 1.572080   225.1433   332.1   479.8011 6.886521          ?        ? 
1 1 1    3   21    3 o 278.1810 1.897204   237.2094   323.7   774.0570 10.55532          ?        ? 
1 1 1    3   21    4 o 163.9070 1.275122   219.9524   266.0   268.6946 4.180028          ?        ? 
1 1 1    3   21    5 o 147.2661 1.306898   160.0605   155.1   216.9104 3.849235          ?        ? 
1 1 1    3   21    6 o 322.4941 2.289254   316.8994   169.4   1040.647 14.76542          ?        ? 
1 1 1    3   21    7 o 169.9442 1.415624   215.3136    84.2   288.9031 4.811543          ?        ? 
1 1 1    3   21    8 o 159.6641 1.346676   165.9872   354.2   255.0118 4.300317          ?        ? 
1 1 1    3   21    9 o 303.9009 2.285832   333.1504   357.8   924.7786 13.89333          ?        ? 
1 1 1    3   21   10 o 75.17495 1.120081   84.59500   351.1   56.53563 1.684040          ?        ? 
1 1 1    3   21   11 f 176.0289 1.511902   183.1903   263.0   310.1641 5.322770          ?        ? 
1 1 1    3   21   12 o 28.47244 1.795513   29.15489   201.4   8.119479 1.022453          ?        ? 
1 1 1    3   21   13 o 82.22681 1.115452   83.04649     8.8   67.66232 1.834401          ?        ? 
1 1 1    3   21   14 o 49.07674 1.439980   59.86581   332.6   24.11786 1.413391          ?        ? 
1 1 1    3   21   15 o 84.25114 1.160037   90.11990   177.4   71.06048 1.954689          ?        ? 
1 1 1    3   21   16 o 39.49133 1.522974   31.92850   256.2   15.63752 1.202886          ?        ? 
1 1 1    3   21   17 o 22.29244 2.630519   24.64478   243.7   5.022048 1.172814          ?        ? 
1 1 1    3   21   18 o 47.09967 1.564273   47.05590   144.8   22.31353 1.473535          ?        ? 
1 1 1    3   21   19 o 11.82919 4.218659   10.08092   182.1   1.323174 1.263030          ?        ? 
1 1 1    3   21   20 o 37.37334 1.649515   34.55106   141.4   14.16398 1.232958          ?        ? 
1 1 1    3   21   21 o 56.95603 1.319972   55.49858    65.0   32.80871 1.503607          ?        ? 
1 1 1    3   21   22 o 26.67175 2.029483   22.68448   341.7   7.397748 1.082597          ?        ? 
1 1 1    3   22    0 o 256.1783 2.495017   296.6098   180.0   656.6253 12.78066   656.6253 12.78066 
1 1 1    3   22    1 o 278.5544 1.910854   298.1394   305.3   776.1620 10.64554          ?        ? 
1 1 1    3   22    2 o 224.3202 1.642223   193.9910   109.5   503.3175 7.367675          ?        ? 
1 1 1    3   22    3 o 126.3584 1.094758   146.4845   327.3   159.6831 2.766637          ?        ? 
1 1 1    3   22    4 o 310.8014 2.065757   207.7861   160.4   966.3985 12.84081          ?        ? 
1 1 1    3   22    5 o 143.4822 1.173693   107.8853    96.2   205.9040 3.368080          ?        ? 
1 1 1    3   22    6 o 36.03766 1.418589   90.09755   123.3   12.99117 1.022453          ?        ? 
1 1 1    3   22    7 o 208.7436 1.649517   199.7963   296.5   435.9559 6.886521          ?        ? 
1 1 1    3   22    8 o 61.74203 1.095888   80.18153    17.6   38.13148 1.353247          ?        ? 
1 1 1    3   22    9 o 219.6174 1.800626   224.2330    38.3   482.7482 7.908974          ?        ? 
1 1 1    3   22   10 o 126.3295 1.309249   147.0033   139.5   159.6831 3.307936          ?        ? 
1 1 1    3   22   11 f 70.27448 1.091207   111.5524   133.1   49.40854 1.533679          ?        ? 
1 1 1    3   22   12 o 29.91172 1.809654   41.12588    13.5   8.961499 1.082597          ?        ? 
1 1 1    3   22   13 o 100.1993 1.140469   100.9370   210.0   100.4710 2.285483          ?        ? 
1 1 1    3   22   14 o 21.54191 2.582569   23.53125   330.0   4.661182 1.112669          ?        ? 
1 1 1    3   22   15 o 28.49055 2.058250   25.42997    48.4   8.149551 1.172814          ?        ? 
1 1 1    3   22   16 o 68.76382 1.180778   60.88065   187.4   47.36363 1.623896          ?        ? 
1 1 1    3   22   17 o 20.38625 2.581459   21.49758    14.1   4.210100 1.052525          ?        ? 
1 1 1    3   22   18 o 83.53764 1.205944   78.59657    61.6   70.06810 2.014834          ?        ? 
1 1 1    3   22   19 o 54.14440 1.305205   55.16457   130.0   29.50077 1.413391          ?        ? 
1 1 1    3   22   20 o 15.95059 3.400060   14.18245   299.5   2.796710 1.052525          ?        ? 
1 1 1    3   22   21 o 24.68300 2.071168   24.44099   126.1   6.285078 1.022453          ?        ? 
1 1 1    3   22   22 o 22.53120 2.402441   18.44823   144.6   5.412986 1.082597          ?        ? 
1 1 1    3   23    0 o 210.0789 2.047437   242.1972   180.0   441.5493 8.600634   441.5493 8.600634 
1 1 1    3   23    1 o 234.7353 1.678253   226.2716   108.0   551.1623 7.878902          ?        ? 
1 1 1    3   23    2 o 95.82886 0.9571234   161.2216   352.7   91.84032 1.834401          ?        ? 
1 1 1    3   23    3 o 230.0593 1.607792   226.8673   170.9   529.4201 7.397748          ?        ? 
1 1 1    3   23    4 o 44.47990 1.081734   79.02489   355.8   19.78747 0.9623086          ?        ? 
1 1 1    3   23    5 o 49.89550 1.024594   120.8566   248.5   24.89974 1.022453          ?        ? 
1 1 1    3   23    6 o 174.5026 1.464810   167.6277   103.1   304.6308 5.112265          ?        ? 
1 1 1    3   23    7 o 102.3144 1.131588   102.4376    79.0   104.7112 2.315555          ?        ? 
1 1 1    3   23    8 o 92.88852 1.052170   87.83608   185.0   86.30705 1.954689          ?        ? 
1 1 1    3   23    9 o 30.12112 1.747154   39.47910   233.5   9.081788 1.052525          ?        ? 
1 1 1    3   23   10 o 31.95404 1.788102   56.46018   114.8   10.22453 1.142741          ?        ? 
1 1 1    3   23   11 o 60.91845 1.258797   83.12186   226.5   37.13910 1.533679          ?        ? 
1 1 1    3   23   12 o 130.1923 1.281953   123.7242   221.2   169.6670 3.338008          ?        ? 
1 1 1    3   23   13 o 99.34706 1.195657   89.30850   177.2   98.78699 2.375700          ?        ? 
1 1 1    3   23   14 o 119.1046 1.262426   122.7677   283.3   142.0307 3.007215          ?        ? 
1 1 1    3   23   15 o 88.27441 1.209366   85.60396    55.7   78.03722 2.135122          ?        ? 
1 1 1    3   23   16 o 30.84596 1.852336   30.44285    97.5   9.562942 1.142741          ?        ? 
1 1 1    3   23   17 o 67.40697 1.226852   85.89994     3.5   45.58937 1.653968          ?        ? 
1 1 1    3   23   18 o 48.41507 1.397547   53.76673    35.6   23.57656 1.353247          ?        ? 
1 1 1    3   23   19 o 9.204663 3.710781   15.24904   119.4  0.4811543 1.052525          ?        ? 
1 1 1    3   23   20 o 21.22542 2.762758   20.05472   213.7   4.721327 1.172814          ?        ? 
1 1 1    3   23   21 f 35.50873 1.651444   26.55288    42.5   12.90095 1.172814          ?        ? 
1 1 1    3   23   22 o 17.32976 3.243601   19.55906   210.7   3.458297 1.082597          ?        ? 
1 1 1    3   24    0 f 41.78219 1.552101   57.05257   180.0   17.53206 1.293102   17.53206 1.293102 
1 1 1    3   24    1 o 318.5588 2.119294   347.8915    79.1   1015.326 13.50239          ?        ? 
1 1 1    3   24    2 o 269.9955 1.826635   271.2676    77.6   729.2796 9.863664          ?        ? 
1 1 1    3   24    3 o 312.0784 2.100667   292.9467    73.4   974.5480 13.11145          ?        ? 
1 1 1    3   24    4 o 155.5009 1.257028   164.9270    68.5   241.8703 3.909379          ?        ? 
1 1 1    3   24    5 o 66.88774 0.9666213   84.64610     8.0   44.74735 1.293102          ?        ? 
1 1 1    3   24    6 o 38.92407 1.313394   53.63204   283.3   15.15636 1.022453          ?        ? 
1 1 1    3   24    7 o 22.26377 2.026082   24.18294   218.1   4.961904 0.9021643          ?        ? 
1 1 1    3   24    8 o 191.2371 1.572506   224.0560   198.3   366.0081 6.014429          ?        ? 
1 1 1    3   24    9 o 156.7287 1.448648   167.9816   267.1   245.8398 4.540894          ?        ? 
1 1 1    3   24   10 o 80.34659 1.197697   73.00919   244.7   64.59497 1.924617          ?        ? 
1 1 1    3   24   11 o 144.9641 1.400257   158.8703    42.2   210.3546 4.059740          ?        ? 
1 1 1    3   24   12 o 9.721200 3.853569   29.75794   314.9  0.5112265 1.112669          ?        ? 
1 1 1    3   24   13 o 15.42050 3.818084   10.85086    72.3   2.495988 1.172814          ?        ? 
1 1 1    3   24   14 o 52.21185 1.353515   58.73766   114.0   27.30551 1.413391          ?        ? 
1 1 1    3   24   15 o 65.03136 1.248548   55.31669   132.9   42.37165 1.623896          ?        ? 
1 1 1    3   24   16 o 72.25170 1.227830   67.33191   198.1   52.32553 1.774257          ?        ? 
1 1 1    3   24   17 o 31.50661 1.908942   30.23978   135.6   10.01402 1.202886          ?        ? 
1 1 1    3   24   18 o 23.73134 2.407663   21.75139   328.0   5.743780 1.142741          ?        ? 
1 1 1    3   24   19 o 43.04711 1.467032   47.73637    11.7   18.73495 1.263030          ?        ? 
1 1 1    3   24   20 o 50.30270 1.345103   54.85813   332.2   25.59139 1.353247          ?        ? 
1 1 1    3   24   21 f 31.19934 1.783162   29.81317   235.3   10.01402 1.112669          ?        ? 
1 1 1    3   24   22 o 10.68681 3.944392   12.77534   174.6   1.293102 1.112669          ?        ? 
1 1 1    3   25    0 o 4.391696 3.133675   8.389853   180.0  -1.353247 1.112669  -1.353247 1.112669 
1 1 1    3   25    1 o 202.3825 1.478477   169.3652   243.6   409.7330 5.984357          ?        ? 
1 1 1    3   25    2 o 313.2364 2.054499   293.3047   221.4   981.8856 12.87088          ?        ? 
1 1 1    3   25    3 o 228.5982 1.664110   271.7313   228.9   522.8343 7.608253          ?        ? 
1 1 1    3   25    4 o 194.8246 1.481808   175.8294   125.0   379.7209 5.773852          ?        ? 
1 1 1    3   25    5 o 254.0009 1.941659   301.8104   193.0   645.7091 9.863664          ?        ? 
1 1 1    3   25    6 o 153.6580 1.350387   185.7856    55.6   236.2167 4.149956          ?        ? 
1 1 1    3   25    7 o 25.94014 1.854864   1.977149   352.3   6.736160 0.9623086          ?        ? 
1 1 1    3   25    8 o 122.1468 1.243294   116.3932    91.5   149.2781 3.037287          ?        ? 
1 1 1    3   25    9 o 158.6234 1.450303   129.4691   142.2   251.8241 4.601038          ?        ? 
1 1 1    3   25   10 o 141.0744 1.374915   156.7718   315.8   199.1979 3.879307          ?        ? 
1 1 1    3   25   11 o 25.08970 2.337242   48.77147    62.7   6.315150 1.172814          ?        ? 
1 1 1    3   25   12 o 59.00546 1.299608   59.58804   226.8   34.85361 1.533679          ?        ? 
1 1 1    3   25   13 o 89.38037 1.110289   77.07243    24.3   79.96183 1.984761          ?        ? 
1 1 1    3   25   14 o 47.85247 1.445399   48.26247   106.5   22.94505 1.383319          ?        ? 
1 1 1    3   25   15 o 82.52911 1.184242   82.12643    21.4   68.23370 1.954689          ?        ? 
1 1 1    3   25   16 o 31.71204 1.896576   26.83334    12.2   10.13431 1.202886          ?        ? 
1 1 1    3   25   17 o 23.98123 2.257176   19.94998   337.8   5.833996 1.082597          ?        ? 
1 1 1    3   25   18 o 38.29051 1.570736   42.05528   296.0   14.79550 1.202886          ?        ? 
1 1 1    3   25   19 o 36.27178 1.658156   30.49460   255.8   13.35203 1.202886          ?        ? 
1 1 1    3   25   20 o 17.67539 3.178102   18.72045   129.2   3.428224 1.082597          ?        ? 
1 1 1    3   25   21 o 27.78097 1.948451   29.56391   147.5   8.029263 1.082597          ?        ? 
1 1 1    3   26    0 o 86.97337 1.453110   9.988096   180.0   75.72166 2.526060   75.72166 2.526060 
1 1 1    3   26    1 o 133.7926 1.168788   130.2033   118.5   179.0496 3.127503          ?        ? 
1 1 1    3   26    2 o 41.28778 1.128950   29.98709   336.4   17.05091 0.9322364          ?        ? 
1 1 1    3   26    3 f 74.96322 0.9226649   119.9486    98.9   56.20484 1.383319          ?        ? 
1 1 1    3   26    4 o 80.26796 0.9740820   61.47187   164.9   64.44461 1.563751          ?        ? 
1 1 1    3   26    5 o 176.9615 1.452954   178.2836   107.8   313.3217 5.142337          ?        ? 
1 1 1    3   26    6 o 213.5917 1.788067   183.2384   122.0   456.6756 7.638325          ?        ? 
1 1 1    3   26    7 o 271.7424 1.986422   264.2137   116.9   739.4139 10.79590          ?        ? 
1 1 1    3   26    8 o 36.23458 1.493873   54.03527   139.5   13.14153 1.082597          ?        ? 
1 1 1    3   26    9 o 38.36711 1.450030   37.96209   296.0   14.73535 1.112669          ?        ? 
1 1 1    3   26   10 o 34.64929 1.822592   20.87623    43.5   12.02886 1.263030          ?        ? 
1 1 1    3   26   11 o 100.8457 1.297168   92.83453    52.7   101.7942 2.616277          ?        ? 
1 1 1    3   26   12 o 118.5062 1.268800   114.6375   115.4   140.5873 3.007215          ?        ? 
1 1 1    3   26   13 o 98.85479 1.232031   105.1898   354.7   97.85476 2.435844          ?        ? 
1 1 1    3   26   14 o 61.44448 1.296963   65.25668   218.0   37.83076 1.593824          ?        ? 
1 1 1    3   26   15 o 48.82666 1.354971   63.85197   106.1   23.90735 1.323174          ?        ? 
1 1 1    3   26   16 o 39.65215 1.630558   44.20313   139.7   15.81795 1.293102          ?        ? 
1 1 1    3   26   17 o 51.49710 1.372301   48.99058   124.0   26.67399 1.413391          ?        ? 
1 1 1    3   26   18 o 46.97446 1.472416   49.05083   185.5   22.28346 1.383319          ?        ? 
1 1 1    3   26   19 o 29.60439 2.031600   20.24606   191.6   8.991571 1.202886          ?        ? 
1 1 1    3   26   20 o 11.62445 4.073176   12.01001   262.2   1.473535 1.172814          ?        ? 
1 1 1    3   26   21 o 24.02085 2.566432   20.17674   357.9   6.224934 1.232958          ?        ? 
1 1 1    3   27    0 o 29.08446 2.142825   29.74625   360.0   8.600634 1.232958   8.600634 1.232958 
1 1 1    3   27    1 o 111.4291 1.052521   113.5234   163.5   124.1980 2.345627          ?        ? 
1 1 1    3   27    2 f 77.93040 0.9647117   85.30891    79.9   60.74573 1.503607          ?        ? 
1 1 1    3   27    3 o 290.0252 1.990810   300.2933   155.5   841.9899 11.54770          ?        ? 
1 1 1    3   27    4 o 53.41343 1.041563   68.58209   205.4   28.53847 1.112669          ?        ? 
1 1 1    3   27    5 o 80.97374 0.9655917   96.09162   126.2   65.58735 1.563751          ?        ? 
1 1 1    3   27    6 o 227.7355 1.914704   238.6468   358.8   519.2858 8.720922          ?        ? 
1 1 1    3   27    7 o 126.9649 1.255326   126.4452   154.6   161.3070 3.187647          ?        ? 
1 1 1    3   27    8 o 38.67996 1.438302   62.58374   311.4   14.97593 1.112669          ?        ? 
1 1 1    3   27    9 o 9.102699 3.629549   24.22658   324.8  0.4210100 0.9923807          ?        ? 
1 1 1    3   27   10 f 52.37075 1.378120   41.78954   187.1   27.45587 1.443463          ?        ? 
1 1 1    3   27   11 o 45.45128 1.521760   31.15783   294.2   20.68964 1.383319          ?        ? 
1 1 1    3   27   12 o 103.6413 1.218655   116.9923     3.8   107.5380 2.526060          ?        ? 
1 1 1    3   27   13 o 26.10334 2.534492   34.84164   138.0   6.856449 1.323174          ?        ? 
1 1 1    3   27   14 o 53.99412 1.448076   53.54381    69.4   29.23012 1.563751          ?        ? 
1 1 1    3   27   15 o 26.43970 2.331642   40.44434   256.8   7.066954 1.232958          ?        ? 
1 1 1    3   27   16 o 13.74761 4.016007   2.193331   340.9   2.014834 1.172814          ?        ? 
1 1 1    3   27   17 o 19.71637 2.821689   25.34277   105.7   3.999595 1.112669          ?        ? 
1 1 1    3   27   18 o 47.51579 1.455641   42.65099   113.8   22.82476 1.383319          ?        ? 
1 1 1    3   27   19 o 14.09148 3.984140   10.75519    32.2   2.255411 1.172814          ?        ? 
1 1 1    3   27   20 f 11.58458 3.922614   18.19740   265.4   1.503607 1.082597          ?        ? 
1 1 1    3   27   21 o 9.098486 3.843528   4.382801    22.2  0.5112265 1.202886          ?        ? 
1 1 1    3   28    0 o 211.8809 2.413504   210.4829     0.0   449.4583 10.22453   449.4583 10.22453 
1 1 1    3   28    1 o 91.52103 0.9364582   110.9527   236.0   83.78100 1.714112          ?        ? 
1 1 1    3   28    2 o 125.0406 1.082246   155.7104   339.0   156.4052 2.706493          ?        ? 
1 1 1    3   28    3 f 50.84594 1.035014   87.21917   251.6   25.86205 1.052525          ?        ? 
1 1 1    3   28    4 o 128.6959 1.156658   96.79371    40.9   165.6975 2.977142          ?        ? 
1 1 1    3   28    5 o 104.5456 1.035527   138.2860   338.7   109.3423 2.165194          ?        ? 
1 1 1    3   28    6 o 55.48021 1.029864   56.83141   255.7   30.79388 1.142741          ?        ? 
1 1 1    3   28    7 f 47.47342 1.266905   66.20074    57.2   22.55411 1.202886          ?        ? 
1 1 1    3   28    8 o 34.22434 1.625553   55.02145   330.6   11.72814 1.112669          ?        ? 
1 1 1    3   28    9 o 76.09842 1.086730   85.07525    73.9   57.94902 1.653968          ?        ? 
1 1 1    3   28   10 f 117.4225 1.331730   113.2989   119.0   138.0311 3.127503          ?        ? 
1 1 1    3   28   11 o 95.35485 1.277252   91.17490   333.5   91.02839 2.435844          ?        ? 
1 1 1    3   28   12 o 68.08310 1.347178   69.27583   268.5   46.43139 1.834401          ?        ? 
1 1 1    3   28   13 o 79.72996 1.263536   77.07375   108.8   63.69280 2.014834          ?        ? 
1 1 1    3   28   14 o 61.79373 1.289632   59.95185   215.5   38.28184 1.593824          ?        ? 
1 1 1    3   28   15 o 24.16358 2.551274   33.95782   176.2   5.924213 1.232958          ?        ? 
1 1 1    3   28   16 f 86.97967 1.279229   77.05884     8.0   76.02238 2.225339          ?        ? 
1 1 1    3   28   17 o 17.69621 3.608706   26.45888   125.7   3.398152 1.232958          ?        ? 
1 1 1    3   28   18 f 25.66795 2.636063   24.06178   278.5   6.856449 1.353247          ?        ? 
1 1 1    3   28   19 o 24.74526 2.369774   22.99971   198.4   6.375295 1.172814          ?        ? 
1 1 1    3   28   20 o 13.48760 4.159316   12.40641    50.3   2.225339 1.232958          ?        ? 
1 1 1    3   29    0 o 109.3253 1.472224   67.11652     0.0   119.6270 3.217719   119.6270 3.217719 
1 1 1    3   29    1 o 109.4892 1.126100   121.4250   203.8   119.9277 2.465916          ?        ? 
1 1 1    3   29    2 o 72.86213 1.031817   30.53834   247.1   53.10741 1.503607          ?        ? 
1 1 1    3   29    3 o 194.9720 1.465264   224.3617    21.1   380.4427 5.713707          ?        ? 
1 1 1    3   29    4 o 89.82263 0.9709048   94.65265   283.3   80.71364 1.744184          ?        ? 
1 1 1    3   29    5 o 321.2273 2.097008   298.4413    54.2   1033.670 13.47232          ?        ? 
1 1 1    3   29    6 o 37.69917 1.316184   33.75276   226.5   14.22412 0.9923807          ?        ? 
1 1 1    3   29    7 o 88.33009 1.089446   98.00290    19.1   78.06729 1.924617          ?        ? 
1 1 1    3   29    8 o 66.32683 1.133484   87.04234   187.9   44.02562 1.503607          ?        ? 
1 1 1    3   29    9 f 186.9084 1.439987   181.9846   123.3   349.7691 5.382914          ?        ? 
1 1 1    3   29   10 o 105.2127 1.271909   116.2512   175.6   110.8159 2.676421          ?        ? 
1 1 1    3   29   11 o 61.36377 1.323171   55.98235    79.7   37.71047 1.623896          ?        ? 
1 1 1    3   29   12 o 59.68940 1.360289   64.89042    61.2   35.69564 1.623896          ?        ? 
1 1 1    3   29   13 o 100.3517 1.273587   99.55559    66.2   100.9221 2.556132          ?        ? 
1 1 1    3   29   14 o 69.06714 1.327984   68.45416    38.5   47.87486 1.834401          ?        ? 
1 1 1    3   29   15 o 22.85186 2.697718   17.70327    58.5   5.322770 1.232958          ?        ? 
1 1 1    3   29   16 o 41.88545 1.651312   37.74457   322.8   17.71249 1.383319          ?        ? 
1 1 1    3   29   17 o 7.869664 3.563218   11.99594   141.6 -0.5112265 1.202886          ?        ? 
1 1 1    3   29   18 o 27.04107 2.557810   34.88833   217.7   7.608253 1.383319          ?        ? 
1 1 1    3   29   19 o 17.81933 3.669574   11.67562    17.3   3.638730 1.263030          ?        ? 
1 1 1    3   29   20 o 20.76571 3.185960   18.20345   267.2   4.841615 1.323174          ?        ? 
1 1 1    3   30    0 o 227.4467 2.234939   236.5506   180.0   518.0228 10.16438   518.0228 10.16438 
1 1 1    3   30    1 o 146.4090 1.273469   156.4589    51.8   214.5046 3.728946          ?        ? 
1 1 1    3   30    2 o 78.31062 0.9216266   88.17874   201.1   61.34718 1.443463          ?        ? 
1 1 1    3   30    3 o 39.34206 1.223003   35.66536   190.2   15.48715 0.9623086          ?        ? 
1 1 1    3   30    4 f 127.8679 1.117111   164.7211   208.2   163.5925 2.856854          ?        ? 
1 1 1    3   30    5 o 13.77653 3.310521   26.50029   257.8   1.984761 0.9021643          ?        ? 
1 1 1    3   30    6 o 41.12937 1.279530   76.60635   156.0   16.93062 1.052525          ?        ? 
1 1 1    3   30    7 o 171.3780 1.412555   193.0041   335.7   294.0454 4.841615          ?        ? 
1 1 1    3   30    8 o 77.23417 1.109685   50.54959   266.2   59.69321 1.714112          ?        ? 
1 1 1    3   30    9 o 98.11922 1.103349   81.07332   105.2   96.35115 2.165194          ?        ? 
1 1 1    3   30   10 o 65.96275 1.367688   63.03048   184.9   43.57454 1.804329          ?        ? 
1 1 1    3   30   11 o 8.212849 3.726869   20.48177   266.7 -0.7518036 1.323174          ?        ? 
1 1 1    3   30   12 o 106.1509 1.331492   75.85105     1.4   112.9209 2.826782          ?        ? 
1 1 1    3   30   13 o 74.20612 1.317068   52.84060   307.0   55.21246 1.954689          ?        ? 
1 1 1    3   30   14 o 39.40096 1.793600   32.09022   272.5   15.63752 1.413391          ?        ? 
1 1 1    3   30   15 o 19.48507 3.163854   26.03798   207.6   3.909379 1.232958          ?        ? 
1 1 1    3   30   16 o 38.11755 1.775096   34.46999   211.0   14.70528 1.353247          ?        ? 
1 1 1    3   30   17 o 15.41923 3.974113   13.44312   312.6   2.676421 1.232958          ?        ? 
1 1 1    3   30   18 o 8.578170 3.815553  0.6988069   225.5 -0.2405772 1.323174          ?        ? 
1 1 1    3   30   19 o 31.48972 2.053213   28.27320   206.5   10.31474 1.293102          ?        ? 
1 1 1    3   31    0 o 42.47222 1.669503   44.10752   180.0   18.13350 1.413391   18.13350 1.413391 
1 1 1    3   31    1 o 109.2506 1.045982   104.7133   249.5   119.4165 2.285483          ?        ? 
1 1 1    3   31    2 o 69.15607 0.9131737   79.42805   300.3   47.84478 1.263030          ?        ? 
1 1 1    3   31    3 o 85.72702 0.9997503   87.73974   280.6   73.52639 1.714112          ?        ? 
1 1 1    3   31    4 o 175.9982 1.469450   172.0401   351.2   310.0739 5.172409          ?        ? 
1 1 1    3   31    5 o 105.9296 1.092969   102.1074   326.3   112.2894 2.315555          ?        ? 
1 1 1    3   31    6 o 134.7809 1.238309   111.3405   269.8   181.8162 3.338008          ?        ? 
1 1 1    3   31    7 o 62.81075 1.196935   73.92675   339.0   39.48473 1.503607          ?        ? 
1 1 1    3   31    8 o 174.5524 1.404094   151.1900    55.9   305.0819 4.901759          ?        ? 
1 1 1    3   31    9 o 101.2515 1.232569   105.3809   353.9   102.6362 2.495988          ?        ? 
1 1 1    3   31   10 o 81.53348 1.272470   72.50745   111.8   66.57973 2.074978          ?        ? 
1 1 1    3   31   11 o 90.56265 1.311633   95.04450   259.7   82.18716 2.375700          ?        ? 
1 1 1    3   31   12 o 49.06845 1.654725   42.16391   183.3   24.17801 1.623896          ?        ? 
1 1 1    3   31   13 o 28.49193 2.269243   21.95458   221.1   8.209695 1.293102          ?        ? 
1 1 1    3   31   14 o 11.84533 4.173773   9.155747   211.7   1.323174 1.232958          ?        ? 
1 1 1    3   31   15 o 28.71999 2.198869   17.96869   180.0   8.390128 1.263030          ?        ? 
1 1 1    3   31   16 o 30.74450 2.200794   27.12394   238.5   9.683230 1.353247          ?        ? 
1 1 1    3   31   17 o 17.92195 3.650343   15.14569   322.1   3.578585 1.263030          ?        ? 
1 1 1    3   31   18 o 53.96501 1.476719   37.87177     4.6   29.65113 1.593824          ?        ? 
1 1 1    3   31   19 f 15.43673 4.182218   16.43030   104.7   2.977142 1.323174          ?        ? 
1 1 1    3   32    0 o 136.5344 1.553236   160.7953   180.0   186.5977 4.240172   186.5977 4.240172 
1 1 1    3   32    1 o 142.2421 1.215638   122.8206    68.6   202.4758 3.458297          ?        ? 
1 1 1    3   32    2 o 46.28810 1.169412   39.91595   319.6   21.44144 1.082597          ?        ? 
1 1 1    3   32    3 o 63.36347 1.067844   76.38132    85.3   40.17639 1.353247          ?        ? 
1 1 1    3   32    4 o 161.8853 1.356063   166.4980    17.5   262.3494 4.390533          ?        ? 
1 1 1    3   32    5 o 40.27641 1.381292   53.59542   357.5   16.23896 1.112669          ?        ? 
1 1 1    3   32    6 o 63.64583 1.086731   37.42058   296.6   40.53725 1.383319          ?        ? 
1 1 1    3   32    7 o 68.24098 1.189825   60.67300    65.1   46.61182 1.623896          ?        ? 
1 1 1    3   32    8 o 102.1589 1.162747   77.22839   308.7   104.4706 2.375700          ?        ? 
1 1 1    3   32    9 o 13.70872 4.145723   27.80697   151.8   1.924617 1.232958          ?        ? 
1 1 1    3   32   10 o 29.23495 2.365865   28.89392   296.6   8.600634 1.383319          ?        ? 
1 1 1    3   32   11 o 23.25016 3.039530   24.71558   182.9   5.473131 1.413391          ?        ? 
1 1 1    3   32   12 o 61.97320 1.431471   46.86470   286.0   38.55249 1.774257          ?        ? 
1 1 1    3   32   13 o 8.182293 3.700140   9.610340   210.7 -0.6315150 1.293102          ?        ? 
1 1 1    3   32   14 o 60.27868 1.346990   62.29895    52.8   36.53765 1.623896          ?        ? 
1 1 1    3   32   15 o 27.96081 2.419899   22.64485   349.1   7.999191 1.353247          ?        ? 
1 1 1    3   32   16 o 13.12573 4.178620   20.41421   353.0   1.894545 1.232958          ?        ? 
1 1 1    3   32   17 o 36.10039 1.915933   31.70130   264.3   13.35203 1.383319          ?        ? 
1 1 1    3   32   18 o 13.51259 4.096544   1.079556   202.4   2.165194 1.202886          ?        ? 
1 1 1    3   32   19 o 28.62818 2.363487   26.08520   109.3   8.781067 1.353247          ?        ? 
1 1 1    3   33    0 o 185.5645 2.074920   198.0708    -0.0   344.8974 7.698469   344.8974 7.698469 
1 1 1    3   33    1 o 115.7039 1.130591   108.2473   343.3   133.9714 2.616277          ?        ? 
1 1 1    3   33    2 o 133.7790 1.191385   140.0665   159.3   179.1097 3.187647          ?        ? 
1 1 1    3   33    3 o 76.37901 1.003993   83.61507   190.0   58.37003 1.533679          ?        ? 
1 1 1    3   33    4 o 31.09169 1.692615   12.84673    34.5   9.683230 1.052525          ?        ? 
1 1 1    3   33    5 o 133.4828 1.137707   137.1369   132.2   178.3278 3.037287          ?        ? 
1 1 1    3   33    6 o 45.42748 1.290864   85.25809    38.9   20.65956 1.172814          ?        ? 
1 1 1    3   33    7 o 74.97469 1.103018   76.63960   196.8   56.26498 1.653968          ?        ? 
1 1 1    3   33    8 o 78.23720 1.153114   58.36054   190.7   61.28703 1.804329          ?        ? 
1 1 1    3   33    9 o 111.5518 1.159194   89.40557   111.2   124.6190 2.586205          ?        ? 
1 1 1    3   33   10 o 40.06417 1.838969   34.70424   212.0   16.11867 1.473535          ?        ? 
1 1 1    3   33   11 o 105.9909 1.319316   95.98175   139.8   112.6503 2.796710          ?        ? 
1 1 1    3   33   12 o 31.71259 2.181025   22.54336   133.9   10.16438 1.383319          ?        ? 
1 1 1    3   33   13 o 16.64042 4.015874   24.88023   240.4   3.007215 1.323174          ?        ? 
1 1 1    3   33   14 o 27.57823 2.562511   29.76824   152.6   7.788685 1.413391          ?        ? 
1 1 1    3   33   15 o 17.04769 3.954167   24.89885    25.6   3.247792 1.323174          ?        ? 
1 1 1    3   33   16 o 44.32179 1.628390   45.52860   134.0   19.96791 1.443463          ?        ? 
1 1 1    3   33   17 o 18.22464 3.426142   14.15334   175.4   3.728946 1.202886          ?        ? 
1 1 1    3   33   18 o 12.64340 4.236901   12.12457    18.8   1.954689 1.263030          ?        ? 
1 1 1    3   34    0 o 9.101574 5.105585   32.42367     0.0   1.142741 1.383319   1.142741 1.383319 
1 1 1    3   34    1 o 109.0474 1.061720   98.61183   155.4   118.9955 2.315555          ?        ? 
1 1 1    3   34    2 o 47.34232 1.206892   59.73727   214.7   22.43382 1.142741          ?        ? 
1 1 1    3   34    3 o 113.6033 1.098554   102.7628   307.2   129.1599 2.495988          ?        ? 
1 1 1    3   34    4 o 73.73030 1.040060   68.88033   306.3   54.40051 1.533679          ?        ? 
1 1 1    3   34    5 o 60.98652 1.158773   60.65618   121.4   37.22932 1.413391          ?        ? 
1 1 1    3   34    6 o 35.07520 1.628988   37.65023   146.6   12.32958 1.142741          ?        ? 
1 1 1    3   34    7 o 44.97624 1.437539   36.06993   189.3   20.26863 1.293102          ?        ? 
1 1 1    3   34    8 o 34.91899 1.851574   30.93344    77.9   12.23936 1.293102          ?        ? 
1 1 1    3   34    9 o 61.25244 1.251933   55.16763     5.3   37.59018 1.533679          ?        ? 
1 1 1    3   34   10 o 27.93874 2.475629   13.49985   141.8   7.878902 1.383319          ?        ? 
1 1 1    3   34   11 f 16.02743 4.379788   33.65034   273.4   2.766637 1.443463          ?        ? 
1 1 1    3   34   12 o 43.58311 1.759488   28.73595    48.7   19.15596 1.533679          ?        ? 
1 1 1    3   34   13 o 24.45370 2.766957   18.71106   285.6   6.134717 1.353247          ?        ? 
1 1 1    3   34   14 o 32.46827 2.176573   35.94393   305.6   10.76583 1.413391          ?        ? 
1 1 1    3   34   15 o 13.69889 4.266668   16.22631    52.0   2.105050 1.293102          ?        ? 
1 1 1    3   34   16 o 26.16333 2.586152   21.40309   167.3   7.157170 1.353247          ?        ? 
1 1 1    3   34   17 o 19.77165 3.551233   21.74639   259.4   4.450677 1.353247          ?        ? 
1 1 1    3   34   18 f 13.12857 4.385608   4.203803   198.0   2.195267 1.353247          ?        ? 
1 1 1    3   35    0 o 37.90734 2.116092   42.34558     0.0   14.52485 1.593824   14.52485 1.593824 
1 1 1    3   35    1 o 46.53905 1.260032   41.18335    27.5   21.68202 1.172814          ?        ? 
1 1 1    3   35    2 o 79.64708 1.019432   82.94528    24.9   63.48230 1.623896          ?        ? 
1 1 1    3   35    3 o 30.98627 1.746898   23.18236   175.0   9.623086 1.082597          ?        ? 
1 1 1    3   35    4 o 105.5939 1.039486   94.09547   151.8   111.5977 2.195267          ?        ? 
1 1 1    3   35    5 o 119.8884 1.116213   104.1035   190.2   143.8952 2.676421          ?        ? 
1 1 1    3   35    6 o 32.94616 1.734256   8.332098   180.6   10.88612 1.142741          ?        ? 
1 1 1    3   35    7 f 43.43769 1.453841   49.03141   172.3   18.91538 1.263030          ?        ? 
1 1 1    3   35    8 o 93.34508 1.240320   91.29259   342.7   87.29943 2.315555          ?        ? 
1 1 1    3   35    9 o 11.99551 4.132504   5.012923    80.6   1.353247 1.202886          ?        ? 
1 1 1    3   35   10 o 18.74939 3.898559   19.35262   211.1   3.759018 1.413391          ?        ? 
1 1 1    3   35   11 o 86.15242 1.308966   71.79440   257.2   74.54884 2.255411          ?        ? 
1 1 1    3   35   12 o 57.03307 1.476372   47.94276   266.5   32.74857 1.684040          ?        ? 
1 1 1    3   35   13 o 31.26904 2.356220   26.00233   180.4   9.983953 1.473535          ?        ? 
1 1 1    3   35   14 o 37.25078 2.098951   33.69807   340.2   14.19405 1.563751          ?        ? 
1 1 1    3   35   15 o 68.47194 1.361487   57.31481    90.4   47.42377 1.864473          ?        ? 
1 1 1    3   35   16 o 14.87859 4.303445   14.02336   204.4   2.646349 1.353247          ?        ? 
1 1 1    3   35   17 o 10.35472 4.253930   15.50284   335.3  0.9021643 1.413391          ?        ? 
1 1 1    3   36    0 o 42.91721 1.899905   38.45139   360.0   18.55451 1.623896   18.55451 1.623896 
1 1 1    3   36    1 o 85.54652 1.089742   72.39953   310.0   73.25574 1.864473          ?        ? 
1 1 1    3   36    2 o 70.40672 1.046445   85.11032    45.1   49.61904 1.473535          ?        ? 
1 1 1    3   36    3 f 23.52509 2.364856   8.630986    15.8   5.563347 1.112669          ?        ? 
1 1 1    3   36    4 o 55.75327 1.159665   50.32351   127.4   31.12467 1.293102          ?        ? 
1 1 1    3   36    5 o 46.68214 1.320589   39.69367   273.7   21.83238 1.232958          ?        ? 
1 1 1    3   36    6 f 35.26739 1.662745   21.46474   104.0   12.47994 1.172814          ?        ? 
1 1 1    3   36    7 o 20.47224 2.937846   16.36997   128.4   4.240172 1.202886          ?        ? 
1 1 1    3   36    8 o 18.46013 3.467190   7.754053   356.5   3.578585 1.232958          ?        ? 
1 1 1    3   36    9 o 26.54668 2.265605   35.54277   328.7   7.127099 1.202886          ?        ? 
1 1 1    3   36   10 f 76.48610 1.336783   71.29798   197.7   58.76097 2.044906          ?        ? 
1 1 1    3   36   11 o 60.63599 1.512634   61.45335   170.2   37.01881 1.834401          ?        ? 
1 1 1    3   36   12 o 43.91662 1.677651   51.00681   236.1   19.48675 1.473535          ?        ? 
1 1 1    3   36   13 o 9.854102 4.062041   13.72956   136.1  0.4811543 1.293102          ?        ? 
1 1 1    3   36   14 o 69.56533 1.361702   59.43108   337.7   48.95745 1.894545          ?        ? 
1 1 1    3   36   15 o 15.11142 4.281948   15.22449     0.2   2.676421 1.353247          ?        ? 
1 1 1    3   36   16 f 32.90963 2.147382   31.40143   162.9   11.30713 1.413391          ?        ? 
1 1 1    3   36   17 o 13.55549 4.275627   8.465212   178.0   2.345627 1.293102          ?        ? 
1 1 1    3   37    0 o 6.887766 4.502102   1.664239   180.0      -0.06 1.473535      -0.06 1.473535 
1 1 1    3   37    1 o 10.25199 3.825806   20.17132    76.2  0.8119479 1.052525          ?        ? 
1 1 1    3   37    2 o 84.90408 1.080278   75.56931   185.9   72.17315 1.834401          ?        ? 
1 1 1    3   37    3 o 84.35480 1.016014   78.15150   121.3   71.24091 1.714112          ?        ? 
1 1 1    3   37    4 o 47.78946 1.289989   43.23252   182.1   22.88490 1.232958          ?        ? 
1 1 1    3   37    5 o 73.04616 1.111555   75.22451    17.1   53.43820 1.623896          ?        ? 
1 1 1    3   37    6 o 29.75554 1.869685   35.94440   268.8   8.901355 1.112669          ?        ? 
1 1 1    3   37    7 o 82.64986 1.200705   67.82585   352.4   68.47427 1.984761          ?        ? 
1 1 1    3   37    8 o 43.41449 1.523886   46.55771   236.4   18.94545 1.323174          ?        ? 
1 1 1    3   37    9 o 23.51287 2.621879   22.13477   236.4   5.623491 1.232958          ?        ? 
1 1 1    3   37   10 o 96.28756 1.405422   98.39909    48.5   93.25372 2.706493          ?        ? 
1 1 1    3   37   11 o 24.39677 2.896677   18.80470   178.7   6.134717 1.413391          ?        ? 
1 1 1    3   37   12 o 23.98365 2.883878   24.50386   194.3   5.984357 1.383319          ?        ? 
1 1 1    3   37   13 o 10.91833 4.338452   7.354859     8.1  0.9021643 1.413391          ?        ? 
1 1 1    3   37   14 o 13.36760 4.576377   19.01004     4.6   1.984761 1.473535          ?        ? 
1 1 1    3   37   15 o 32.35492 2.416559   26.18203    83.8   11.00640 1.563751          ?        ? 
1 1 1    3   37   16 o 22.23101 3.246508   28.23430    35.8   5.563347 1.443463          ?        ? 
1 1 1    3   38    0 o 38.12440 2.103749   29.27585     0.0   14.70528 1.593824   14.70528 1.593824 
1 1 1    3   38    1 o 55.52834 1.164362   40.02140   269.8   30.88409 1.293102          ?        ? 
1 1 1    3   38    2 o 31.81967 1.795653   14.84707    30.7   10.16438 1.142741          ?        ? 
1 1 1    3   38    3 o 55.73962 1.159949   31.93524   231.5   31.12467 1.293102          ?        ? 
1 1 1    3   38    4 o 42.31202 1.350375   35.47329   194.7   17.95307 1.142741          ?        ? 
1 1 1    3   38    5 o 82.87559 1.070434   81.47254   282.6   68.80507 1.774257          ?        ? 
1 1 1    3   38    6 o 72.62355 1.076615   66.41492   246.5   52.86683 1.563751          ?        ? 
1 1 1    3   38    7 o 11.31073 4.062056   10.65914   135.5   1.142741 1.172814          ?        ? 
1 1 1    3   38    8 o 95.08918 1.249195   80.27863   152.6   90.78780 2.375700          ?        ? 
1 1 1    3   38    9 o 23.61376 2.547001   22.87215   176.0   5.683635 1.202886          ?        ? 
1 1 1    3   38   10 o 42.08403 1.536334   40.27174   171.9   17.86285 1.293102          ?        ? 
1 1 1    3   38   11 o 27.23589 2.705135   26.56080   147.7   7.668397 1.473535          ?        ? 
1 1 1    3   38   12 o 22.11273 3.263873   23.06186   241.9   5.172409 1.443463          ?        ? 
1 1 1    3   38   13 o 11.12721 4.326873   13.14525   262.3   1.052525 1.383319          ?        ? 
1 1 1    3   38   14 o 26.27392 2.746950   17.10047    19.8   7.337603 1.443463          ?        ? 
1 1 1    3   38   15 o 10.69319 4.389381   4.384784    70.6  0.9623086 1.503607          ?        ? 
1 1 1    3   39    0 o 21.95414 3.807971   30.76407   180.0   5.232553 1.533679   5.232553 1.533679 
1 1 1    3   39    1 o 9.458201 3.748395  0.8333175    46.5  0.5112265 1.052525          ?        ? 
1 1 1    3   39    2 o 27.66490 1.956626   19.65510    27.8   7.698469 1.082597          ?        ? 
1 1 1    3   39    3 o 60.77688 1.138030   54.92469   267.1   37.01881 1.383319          ?        ? 
1 1 1    3   39    4 o 10.17330 3.775850   9.639499   168.3  0.8420200 1.022453          ?        ? 
1 1 1    3   39    5 o 47.84404 1.288518   45.90103   251.2   22.97512 1.232958          ?        ? 
1 1 1    3   39    6 o 38.13439 1.458879   32.04009   312.0   14.61506 1.112669          ?        ? 
1 1 1    3   39    7 o 104.8181 1.233663   84.50668   256.2   110.3347 2.586205          ?        ? 
1 1 1    3   39    8 o 17.44954 3.650944   14.17290   129.3   3.277864 1.232958          ?        ? 
1 1 1    3   39    9 o 7.525723 3.477914   7.134054    11.1 -0.9021643 1.232958          ?        ? 
1 1 1    3   39   10 o 64.98637 1.226275   54.61572    43.3   42.52201 1.593824          ?        ? 
1 1 1    3   39   11 o 9.682446 4.131131   5.626425   218.1  0.2105050 1.413391          ?        ? 
1 1 1    3   39   12 o 35.02348 2.189502   30.32582    42.0   12.63030 1.533679          ?        ? 
1 1 1    3   39   13 o 28.47097 2.640598   28.14573   316.9   8.540489 1.503607          ?        ? 
1 1 1    3   39   14 o 16.86823 4.408247   9.341836   226.7   3.488369 1.503607          ?        ? 
1 1 1    3   39   15 f 37.93932 2.219386   31.47209    59.9   15.27665 1.684040          ?        ? 
1 1 1    3   40    0 o 101.1927 1.441964   80.13235    -0.0   102.6964 2.916998   102.6964 2.916998 
1 1 1    3   40    1 o 52.91018 1.221979   49.64037   350.7   28.08738 1.293102          ?        ? 
1 1 1    3   40    2 o 21.31399 2.398549   9.383251   311.3   4.601038 1.022453          ?        ? 
1 1 1    3   40    3 o 18.97128 2.932510   11.43779   109.6   3.668802 1.112669          ?        ? 
1 1 1    3   40    4 o 52.58576 1.258111   34.15483   305.4   27.75659 1.323174          ?        ? 
1 1 1    3   40    5 o 24.11441 2.244710   20.30813   193.4   5.894140 1.082597          ?        ? 
1 1 1    3   40    6 o 22.85352 2.565937   26.24662   144.9   5.322770 1.172814          ?        ? 
1 1 1    3   40    7 o 46.78923 1.446109   37.53109    77.4   22.04288 1.353247          ?        ? 
1 1 1    3   40    8 o 28.65819 2.203611   20.53832   336.2   8.360056 1.263030          ?        ? 
1 1 1    3   40    9 o 59.62954 1.311222   48.86607   329.3   35.84600 1.563751          ?        ? 
1 1 1    3   40   10 o 53.40050 1.464173   53.97345   309.5   28.83919 1.563751          ?        ? 
1 1 1    3   40   11 o 23.79316 3.033357   16.80146   134.3   5.984357 1.443463          ?        ? 
1 1 1    3   40   12 o 11.18950 4.465768   3.788768    86.1   1.022453 1.503607          ?        ? 
1 1 1    3   40   13 o 12.36705 4.457484   15.75580   195.1   1.714112 1.413391          ?        ? 
1 1 1    3   40   14 o 16.22614 4.421222   11.06857    89.8   3.368080 1.473535          ?        ? 
1 1 1    3   41    0 o 87.64000 1.596750   86.51893   180.0   77.13505 2.796710   77.13505 2.796710 
1 1 1    3   41    1 o 28.57172 1.894526   21.06287    96.6   8.239767 1.082597          ?        ? 
1 1 1    3   41    2 o 52.83341 1.223754   41.73386    89.2   28.02724 1.293102          ?        ? 
1 1 1    3   41    3 o 57.91819 1.194201   56.66605    75.3   33.68080 1.383319          ?        ? 
1 1 1    3   41    4 o 33.92965 1.683987   14.65650   208.3   11.60785 1.142741          ?        ? 
1 1 1    3   41    5 o 29.26112 1.901276   21.24654   184.4   8.660777 1.112669          ?        ? 
1 1 1    3   41    6 o 40.35913 1.490228   39.26680    53.7   16.41939 1.202886          ?        ? 
1 1 1    3   41    7 o 22.09697 2.721834   22.27916   131.2   5.022048 1.202886          ?        ? 
1 1 1    3   41    8 o 44.47254 1.589060   36.53349   266.5   20.02805 1.413391          ?        ? 
1 1 1    3   41    9 o 38.50843 1.718032   33.33068   173.6   15.06614 1.323174          ?        ? 
1 1 1    3   41   10 o 24.05286 2.688043   20.81216   237.6   6.044501 1.293102          ?        ? 
1 1 1    3   41   11 o 7.309921 3.489291   12.59687    46.2  -1.533679 1.413391          ?        ? 
1 1 1    3   41   12 o 13.28556 4.574142   14.51394   188.8   2.074978 1.473535          ?        ? 
1 1 1    3   41   13 o 20.02479 3.743038   21.29525   236.7   4.751399 1.443463          ?        ? 
1 1 1    3   42    0 o 28.52589 2.734632   34.61510   360.0   8.450273 1.533679   8.450273 1.533679 
1 1 1    3   42    1 o 58.20602 1.239960   48.42171   303.6   34.04167 1.443463          ?        ? 
1 1 1    3   42    2 o 46.66453 1.288865   36.14967   341.9   21.89252 1.202886          ?        ? 
1 1 1    3   42    3 o 38.31090 1.530653   21.63331   217.4   14.79550 1.172814          ?        ? 
1 1 1    3   42    4 o 53.04516 1.247215   45.21022   191.7   28.29789 1.323174          ?        ? 
1 1 1    3   42    5 o 11.85284 4.030103   16.03789    60.5   1.413391 1.142741          ?        ? 
1 1 1    3   42    6 o 31.83449 1.794817   18.76403   259.2   10.28467 1.142741          ?        ? 
1 1 1    3   42    7 o 34.55886 1.827361   20.32874   286.6   12.14915 1.263030          ?        ? 
1 1 1    3   42    8 o 44.26924 1.562393   40.53443    49.2   19.87769 1.383319          ?        ? 
1 1 1    3   42    9 f 27.24208 2.318160   23.81196   120.9   7.668397 1.263030          ?        ? 
1 1 1    3   42   10 o 30.53185 2.216123   23.68579   105.8   9.653158 1.353247          ?        ? 
1 1 1    3   42   11 o 16.93568 4.332585   9.160652    33.8   3.458297 1.473535          ?        ? 
1 1 1    3   42   12 o 25.44855 2.895125   14.20465   271.5   7.097026 1.473535          ?        ? 
1 1 1    3   42   13 o 10.73103 4.310872   12.66181   299.2   1.172814 1.413391          ?        ? 
1 1 1    3   43    0 o 54.94827 1.672621   44.07219   360.0   30.43301 1.834401   30.43301 1.834401 
1 1 1    3   43    1 f 42.38137 1.454599   32.30103   266.9   18.10343 1.232958          ?        ? 
1 1 1    3   43    2 o 21.11586 2.563469   19.56765    64.4   4.570966 1.082597          ?        ? 
1 1 1    3   43    3 o 19.14779 2.826950   10.89233    62.2   3.789090 1.082597          ?        ? 
1 1 1    3   43    4 o 15.49251 3.647288   10.08235    42.6   2.646349 1.112669          ?        ? 
1 1 1    3   43    5 o 9.794307 3.781297   6.603863   187.4  0.7518036 1.052525          ?        ? 
1 1 1    3   43    6 o 23.80583 2.336968   33.02509   194.8   5.833996 1.112669          ?        ? 
1 1 1    3   43    7 o 44.24587 1.563218   27.88605   330.7   19.87769 1.383319          ?        ? 
1 1 1    3   43    8 o 14.69453 4.062171   10.56104   272.5   2.465916 1.232958          ?        ? 
1 1 1    3   43    9 o 20.25694 3.340204   25.63872   142.1   4.450677 1.353247          ?        ? 
1 1 1    3   43   10 o 9.088736 3.892371   7.491713   359.4  0.2706493 1.263030          ?        ? 
1 1 1    3   43   11 o 33.30547 2.347590   30.02450    82.8   11.78828 1.563751          ?        ? 
1 1 1    3   43   12 o 13.13842 4.482013   3.957740   234.7   2.225339 1.413391          ?        ? 
1 1 1    3   44    0 o 17.59561 5.302455   14.96963   180.0   3.999595 1.623896   3.999595 1.623896 
1 1 1    3   44    1 o 66.20071 1.135643   52.18034    54.4   44.11584 1.503607          ?        ? 
1 1 1    3   44    2 o 30.04047 1.952057   27.77093   327.5   9.202076 1.172814          ?        ? 
1 1 1    3   44    3 o 36.15619 1.663458   22.59584    54.4   13.26182 1.202886          ?        ? 
1 1 1    3   44    4 o 17.67076 3.271348   15.33028   253.9   3.398152 1.112669          ?        ? 
1 1 1    3   44    5 o 31.20581 1.879159   22.49509   326.1   9.953879 1.172814          ?        ? 
1 1 1    3   44    6 o 66.42879 1.222283   46.38873   319.5   44.53685 1.623896          ?        ? 
1 1 1    3   44    7 o 22.54165 2.801548   18.69214   244.9   5.352841 1.263030          ?        ? 
1 1 1    3   44    8 o 7.896562 3.587125   5.073268   341.4 -0.4510822 1.232958          ?        ? 
1 1 1    3   44    9 o 12.10037 4.228173   9.958122   204.6   1.653968 1.263030          ?        ? 
1 1 1    3   44   10 o 16.09457 3.948277   12.74874   265.0   3.157575 1.263030          ?        ? 
1 1 1    3   44   11 o 8.375590 3.859233   5.885398   144.9 -0.4811543 1.503607          ?        ? 
1 1 1    3   45    0 o 23.38994 3.400459   2.996218     0.0   5.864068 1.533679   5.864068 1.533679 
1 1 1    3   45    1 o 40.54624 1.557518   37.95863   138.5   16.69004 1.263030          ?        ? 
1 1 1    3   45    2 o 38.01065 1.582301   37.56382    87.8   14.67521 1.202886          ?        ? 
1 1 1    3   45    3 o 26.65574 2.143519   18.67204    38.9   7.307531 1.142741          ?        ? 
1 1 1    3   45    4 o 19.08803 2.993346   22.45198   289.7   3.849235 1.142741          ?        ? 
1 1 1    3   45    5 o 12.78161 4.016955   13.76471    65.0   1.834401 1.142741          ?        ? 
1 1 1    3   45    6 o 31.82046 1.984619   23.51766   340.1   10.43503 1.263030          ?        ? 
1 1 1    3   45    7 o 43.21016 1.670282   29.87221    33.0   19.12588 1.443463          ?        ? 
1 1 1    3   45    8 f 13.33168 3.917188   13.84898   152.9   2.105050 1.112669          ?        ? 
1 1 1    3   45    9 o 16.07700 3.718614   8.769175   227.8   3.097431 1.172814          ?        ? 
1 1 1    3   45   10 o 14.72900 4.057997   10.09547   174.6   2.736565 1.232958          ?        ? 
1 1 1    3   46    0 o 42.74526 1.943301   36.39050   180.0   18.61466 1.653968   18.61466 1.653968 
1 1 1    3   46    1 o 37.18607 1.617388   24.98129   111.0   14.07376 1.202886          ?        ? 
1 1 1    3   46    2 o 49.18102 1.375781   31.77219   167.1   24.50880 1.353247          ?        ? 
1 1 1    3   46    3 o 55.33131 1.304382   35.51041   173.0   31.00438 1.443463          ?        ? 
1 1 1    3   46    4 o 19.08416 2.993953   19.41847   115.7   3.909379 1.142741          ?        ? 
1 1 1    3   46    5 o 39.13981 1.613485   34.50930   214.1   15.66759 1.263030          ?        ? 
1 1 1    3   46    6 o 25.15192 2.331460   27.22967   242.1   6.645944 1.172814          ?        ? 
1 1 1    3   46    7 o 6.567838 3.199481   10.92649   259.0  -1.954689 1.353247          ?        ? 
1 1 1    3   46    8 o 9.858042 4.089833   9.612628    38.0  0.7518036 1.323174          ?        ? 
1 1 1    3   47    0 o 5.504474 3.877694   7.489075   180.0  -1.263030 1.563751  -1.263030 1.563751 
1 1 1    3   47    1 o 29.01675 2.020925   20.42139    29.6   8.720922 1.172814          ?        ? 
1 1 1    3   47    2 o 48.43904 1.303732   37.03876   139.6   23.81714 1.263030          ?        ? 
1 1 1    3   47    3 o 54.15374 1.332746   40.33084   130.5   29.80149 1.443463          ?        ? 
1 1 1    3   47    4 o 48.19363 1.435168   40.13117   156.7   23.69685 1.383319          ?        ? 
1 1 1    3   47    5 o 35.41164 1.783354   27.84737   243.2   12.99117 1.263030          ?        ? 
1 1 1    3   47    6 o 13.62860 3.958710   8.501860    62.4   2.285483 1.142741          ?        ? 
1 1 1    3   47    7 o 8.239391 3.694520   3.909649   104.5      -0.09 1.263030          ?        ? 
1 1 1    3   48    0 o 7.318347 4.795461   4.335474   180.0  0.2706493 1.684040  0.2706493 1.684040 
1 1 1    3   48    1 o 32.97179 1.869716   24.00928   308.9   11.30713 1.232958          ?        ? 
1 1 1    3   48    2 o 13.84118 3.938950   10.18747    81.0   2.345627 1.142741          ?        ? 
1 1 1    3   48    3 o 21.99526 2.802781   23.40989    92.6   5.292697 1.232958          ?        ? 
1 1 1    3   48    4 o 16.20477 3.360351   14.41745   222.3   3.067359 1.052525          ?        ? 
1 1 1    3   48    5 o 17.05787 3.203151   9.682027   131.2   3.368080 1.052525          ?        ? 
1 1 1    3   49    0 o 35.00484 2.606005   24.14357   180.0   12.99117 1.804329   12.99117 1.804329 
1 1 1    4    0    0 o 255.7647 4.783255   1099.724   180.0   655.0916 24.44865   655.0916 24.44865 
1 1 1    4    0    1 o 56.41944 0.6931480   733.9316   180.0   31.84640 0.7818757   31.84640 0.7818757 
1 1 1    4    0    2 o 108.2980 1.319417   283.9555   180.0   117.3415 2.856854   117.3415 2.856854 
1 1 1    4    0    3 o 538.2132 5.130283   503.1296   180.0   2898.955 55.21246   2898.955 55.21246 
1 1 1    4    0    4 o 89.96874 1.488328   64.09052     0.0   81.01436 2.676421   81.01436 2.676421 
1 1 1    4    0    5 o 118.3593 1.461431   36.94514   180.0   140.1663 3.458297   140.1663 3.458297 
1 1 1    4    0    6 o 33.58964 0.8966948   300.9522   180.0   11.30713 0.6014429   11.30713 0.6014429 
1 1 1    4    0    7 o 132.8371 1.641844   239.1984   180.0   176.5536 4.360461   176.5536 4.360461 
1 1 1    4    0    8 o 69.04963 1.220293   191.5684     0.0   47.72449 1.684040   47.72449 1.684040 
1 1 1    4    0    9 f 241.1833 3.037180   442.0331     0.0   582.0764 14.64513   582.0764 14.64513 
1 1 1    4    0   10 o 343.8501 3.547234   252.2747   180.0   1183.068 24.38851   1183.068 24.38851 
1 1 1    4    0   11 o 196.8093 2.139745   314.8652   180.0   387.5397 8.420200   387.5397 8.420200 
1 1 1    4    0   12 o 254.8058 2.732865   299.0955     0.0   649.7388 13.92340   649.7388 13.92340 
1 1 1    4    0   13 o 153.4113 1.853024   166.0318     0.0   235.5250 5.683635   235.5250 5.683635 
1 1 1    4    0   14 o 14.95787 4.186295   20.63346     0.0   2.706493 1.082597   2.706493 1.082597 
1 1 1    4    0   15 o 117.1053 1.644218   165.1812     0.0   137.2793 3.849235   137.2793 3.849235 
1 1 1    4    0   16 o 68.41655 1.341763   14.89217   180.0   46.88247 1.834401   46.88247 1.834401 
1 1 1    4    0   17 o 21.06293 2.809127  0.5631012   180.0   4.540894 1.172814   4.540894 1.172814 
1 1 1    4    0   18 f 95.89108 1.616104   125.8753   180.0   92.11098 3.097431   92.11098 3.097431 
1 1 1    4    0   19 f 62.86681 1.700886   78.20220   180.0   39.66516 2.135122   39.66516 2.135122 
1 1 1    4    0   20 o 12.62083 5.466111   28.16905     0.0   2.315555 1.413391   2.315555 1.413391 
1 1 1    4    0   21 o 12.83851 6.366992   15.53597     0.0   2.556132 1.954689   2.556132 1.954689 
1 1 1    4    0   22 o 76.46967 2.542667   71.35120   180.0   59.36241 3.879307   59.36241 3.879307 
1 1 1    4    0   23 o 41.07447 1.949552   40.23483     0.0   17.17119 1.593824   17.17119 1.593824 
1 1 1    4    0   24 o 18.43376 6.924182   25.56829     0.0   5.172409 2.375700   5.172409 2.375700 
1 1 1    4    0   25 x        ?      ?   8.284770   180.0          ?        ?          ?        ? 
1 1 1    4    1    0 o 149.6132 1.688877   205.3127     0.0   223.9473 5.052120   223.9473 5.052120 
1 1 1    4    1    1 o 145.4453 1.075148   954.7003   117.5   211.5575 3.127503          ?        ? 
1 1 1    4    1    2 o 474.1592 3.244038   1454.746   123.3   2249.336 30.76381          ?        ? 
1 1 1    4    1    3 o 176.9094 1.359889   301.6610   117.2   312.9909 4.811543          ?        ? 
1 1 1    4    1    4 o 186.1400 1.567099   315.8586   321.0   346.5213 5.833996          ?        ? 
1 1 1    4    1    5 o 180.9304 1.537427   321.9037   174.3   327.4255 5.563347          ?        ? 
1 1 1    4    1    6 o 165.6291 1.443427   229.1837   202.4   274.3783 4.781471          ?        ? 
1 1 1    4    1    7 o 296.6331 2.159357   336.8110   314.2   880.1816 12.81073          ?        ? 
1 1 1    4    1    8 o 143.1539 1.228902   160.5635   225.5   204.9417 3.518441          ?        ? 
1 1 1    4    1    9 o 102.9415 1.066269   131.4783    62.3   105.9742 2.195267          ?        ? 
1 1 1    4    1   10 o 190.4829 1.562945   247.5780   216.3   362.8806 5.954284          ?        ? 
1 1 1    4    1   11 o 87.06676 1.018906   197.2459   317.6   75.81188 1.774257          ?        ? 
1 1 1    4    1   12 o 102.8795 1.037681   197.9130   323.4   105.8540 2.135122          ?        ? 
1 1 1    4    1   13 o 60.01742 0.9269554   20.67445   271.8   36.02643 1.112669          ?        ? 
1 1 1    4    1   14 o 98.40601 1.008456   88.15166   131.3   96.86238 1.984761          ?        ? 
1 1 1    4    1   15 o 40.80883 1.068509   44.40769    10.4   16.65997 0.8720922          ?        ? 
1 1 1    4    1   16 o 92.01319 1.094861   120.6285   241.7   84.71323 2.014834          ?        ? 
1 1 1    4    1   17 o 48.04066 1.126751   73.93446   184.1   23.09541 1.082597          ?        ? 
1 1 1    4    1   18 o 62.20839 1.136013   74.21417   175.2   38.73292 1.413391          ?        ? 
1 1 1    4    1   19 o 47.37362 1.523488   46.51470   357.1   22.49397 1.443463          ?        ? 
1 1 1    4    1   20 o 60.26302 1.347340   63.07388   338.8   36.41737 1.623896          ?        ? 
1 1 1    4    1   21 o 48.46846 1.396007   68.25679    36.1   23.60663 1.353247          ?        ? 
1 1 1    4    1   22 o 70.63132 1.405015   77.08217   209.7   50.25056 1.984761          ?        ? 
1 1 1    4    1   23 o 17.87492 3.659158   21.27502   234.8   3.548513 1.263030          ?        ? 
1 1 1    4    1   24 f 50.19033 3.145601   47.00097   135.6   27.27543 3.157575          ?        ? 
1 1 1    4    1   25 o 9.290316 4.455820   2.297225   259.2  -1.684040 2.375700          ?        ? 
1 1 1    4    2    0 o 16.96582 0.5329106   671.0126     0.0   2.886926 0.1804329   2.886926 0.1804329 
1 1 1    4    2    1 o 198.1822 1.388420   603.5706   270.4   392.8023 5.503202          ?        ? 
1 1 1    4    2    2 o 120.5537 1.035218   643.7783   142.3   145.3387 2.495988          ?        ? 
1 1 1    4    2    3 o 292.8123 1.910241   191.3893   352.8   857.5072 11.18684          ?        ? 
1 1 1    4    2    4 o 340.6188 2.388158   543.0671    17.6   1160.544 16.26903          ?        ? 
1 1 1    4    2    5 o 118.5261 1.002184   190.4262   169.1   140.4971 2.375700          ?        ? 
1 1 1    4    2    6 o 72.27223 0.7697766   131.2418   353.5   52.23531 1.112669          ?        ? 
1 1 1    4    2    7 o 164.6418 1.333359   376.8915   275.2   271.1004 4.390533          ?        ? 
1 1 1    4    2    8 o 143.7310 1.140278   154.0385   259.4   206.5956 3.277864          ?        ? 
1 1 1    4    2    9 o 117.9186 1.007347   44.58627   359.4   139.0536 2.375700          ?        ? 
1 1 1    4    2   10 o 357.2912 2.360886   395.2027    38.8   1276.923 16.87047          ?        ? 
1 1 1    4    2   11 o 436.3045 3.253245   486.3886   284.5   1905.100 28.38811          ?        ? 
1 1 1    4    2   12 o 115.8685 1.090054   130.2974   272.3   134.2721 2.526060          ?        ? 
1 1 1    4    2   13 o 74.98344 0.9825738   94.85837   333.1   56.23491 1.473535          ?        ? 
1 1 1    4    2   14 o 80.15527 0.9754514   93.13443    46.4   64.26418 1.563751          ?        ? 
1 1 1    4    2   15 o 115.9120 1.206394   111.9793   100.0   134.4225 2.796710          ?        ? 
1 1 1    4    2   16 o 90.84781 1.059254   92.39352    32.1   82.57811 1.924617          ?        ? 
1 1 1    4    2   17 o 56.06724 1.072717   73.51932   326.6   31.45546 1.202886          ?        ? 
1 1 1    4    2   18 o 83.95078 1.217919   104.6297   338.7   70.54926 2.044906          ?        ? 
1 1 1    4    2   19 o 44.78913 1.174978   59.57256     7.2   20.08819 1.052525          ?        ? 
1 1 1    4    2   20 o 96.54679 1.245910   104.8053   288.5   93.43416 2.405771          ?        ? 
1 1 1    4    2   21 f 23.03133 2.415556   41.02813    19.4   5.382914 1.112669          ?        ? 
1 1 1    4    2   22 o 34.48716 2.267151   38.33059   337.4   12.11907 1.563751          ?        ? 
1 1 1    4    2   23 f 38.79297 2.209308   40.45599   317.2   15.48715 1.714112          ?        ? 
1 1 1    4    2   24 x        ?      ?   33.14269   197.9          ?        ?          ?        ? 
1 1 1    4    2   25 o 26.37829 3.306099   30.74182   222.3   7.908974 1.744184          ?        ? 
1 1 1    4    3    0 o 21.73235 0.9728155   1.466437     0.0   4.751399 0.4210100   4.751399 0.4210100 
1 1 1    4    3    1 f 454.9420 3.843776   1050.440   241.7   2071.189 34.97390          ?        ? 
1 1 1    4    3    2 o 364.1049 2.514926   741.6699    53.8   1326.061 18.31394          ?        ? 
1 1 1    4    3    3 f 184.4074 1.394287   305.2542   192.6   340.0859 5.142337          ?        ? 
1 1 1    4    3    4 o 240.4452 1.919803   528.9792   148.6   578.2573 9.232149          ?        ? 
1 1 1    4    3    5 o 215.3810 1.480004   223.6449    96.6   463.9831 6.375295          ?        ? 
1 1 1    4    3    6 o 151.8146 1.188508   180.3973   215.0   230.5030 3.608657          ?        ? 
1 1 1    4    3    7 o 322.0486 2.287753   405.9263   139.2   1037.489 14.73535          ?        ? 
1 1 1    4    3    8 o 373.3692 2.621663   455.3352   238.1   1394.385 19.57697          ?        ? 
1 1 1    4    3    9 o 233.1086 1.735116   263.1131    51.2   543.4638 8.089407          ?        ? 
1 1 1    4    3   10 o 336.1674 2.375053   411.1889    83.2   1130.412 15.96831          ?        ? 
1 1 1    4    3   11 o 52.31039 0.9485505   78.48454    79.4   27.36565 0.9923807          ?        ? 
1 1 1    4    3   12 f 256.2995 1.959445   270.5890    68.6   657.1666 10.04410          ?        ? 
1 1 1    4    3   13 o 52.45171 0.9173282   37.81505   248.6   27.51601 0.9623086          ?        ? 
1 1 1    4    3   14 o 146.8599 1.279797   171.1811   248.5   215.7676 3.759018          ?        ? 
1 1 1    4    3   15 o 138.6458 1.301395   153.3347   105.8   192.3414 3.608657          ?        ? 
1 1 1    4    3   16 o 63.24936 1.045998   67.85770   359.7   40.02603 1.323174          ?        ? 
1 1 1    4    3   17 o 49.94180 1.144073   59.47191   167.6   24.95988 1.142741          ?        ? 
1 1 1    4    3   18 o 71.51674 1.009178   64.26540   339.9   51.18279 1.443463          ?        ? 
1 1 1    4    3   19 o 36.86173 1.590828   28.24041   249.3   13.62268 1.172814          ?        ? 
1 1 1    4    3   20 o 68.09148 1.170355   75.13345   240.8   46.46146 1.593824          ?        ? 
1 1 1    4    3   21 o 65.58434 1.123389   64.03531     1.2   43.15353 1.473535          ?        ? 
1 1 1    4    3   22 o 39.01921 2.157963   31.09937   179.6   15.48715 1.684040          ?        ? 
1 1 1    4    3   23 o 7.599794 3.498984   16.12419    21.7 -0.7518036 1.232958          ?        ? 
1 1 1    4    3   24 o 12.17415 5.150396   1.167701   172.4   1.052525 2.165194          ?        ? 
1 1 1    4    3   25 o 27.90165 3.233373   31.75306   320.4   8.811138 1.804329          ?        ? 
1 1 1    4    4    0 o 242.7352 3.334015   7.115472   360.0   589.6847 16.17881   589.6847 16.17881 
1 1 1    4    4    1 o 283.1264 2.283613   544.0925    59.2   801.7835 12.93102          ?        ? 
1 1 1    4    4    2 o 519.2784 3.842422   419.7929   340.3   2698.013 39.90574          ?        ? 
1 1 1    4    4    3 o 472.6003 3.486993   258.7253   227.3   2234.601 32.95907          ?        ? 
1 1 1    4    4    4 o 248.1588 1.660180   161.9154   278.6   615.9377 8.239767          ?        ? 
1 1 1    4    4    5 o 129.0669 1.048485   254.6221    80.4   166.5997 2.706493          ?        ? 
1 1 1    4    4    6 o 92.62297 0.9253170   339.6643   261.7   85.79582 1.714112          ?        ? 
1 1 1    4    4    7 o 155.5041 1.334356   212.2002   174.3   241.8402 4.149956          ?        ? 
1 1 1    4    4    8 o 206.0560 1.984806   235.9811   208.8   424.6487 8.179624          ?        ? 
1 1 1    4    4    9 o 162.5390 1.480120   147.5987   219.3   264.2139 4.811543          ?        ? 
1 1 1    4    4   10 o 475.0498 3.253781   479.8242   235.6   2257.997 30.91417          ?        ? 
1 1 1    4    4   11 o 216.9364 1.663464   224.7695    76.1   470.7193 7.217315          ?        ? 
1 1 1    4    4   12 o 75.84310 0.9912618   77.35214   195.4   57.52802 1.503607          ?        ? 
1 1 1    4    4   13 o 81.57087 0.9769565   89.94040   121.8   66.54966 1.593824          ?        ? 
1 1 1    4    4   14 o 185.1927 1.477685   232.6874   318.5   343.1532 5.473131          ?        ? 
1 1 1    4    4   15 o 88.88263 0.9811729   103.6194   308.6   79.02959 1.744184          ?        ? 
1 1 1    4    4   16 o 80.93209 0.9289315   69.11013   251.4   65.52720 1.503607          ?        ? 
1 1 1    4    4   17 o 59.77861 1.031270   91.68817   190.4   35.75578 1.232958          ?        ? 
1 1 1    4    4   18 o 34.65576 1.475156   29.95038   209.7   12.02886 1.022453          ?        ? 
1 1 1    4    4   19 o 117.1661 1.373144   118.1365   149.1   137.5500 3.217719          ?        ? 
1 1 1    4    4   20 o 50.79737 1.213604   43.37198   186.6   25.86205 1.232958          ?        ? 
1 1 1    4    4   21 o 42.45874 1.487362   51.38308   151.3   18.13350 1.263030          ?        ? 
1 1 1    4    4   22 o 14.30623 3.578870   8.613170    48.5   2.225339 1.022453          ?        ? 
1 1 1    4    4   23 o 32.31913 2.326188   24.66036   134.8   10.79590 1.503607          ?        ? 
1 1 1    4    4   24 o 29.11950 2.943238   22.33364   330.1   9.111859 1.714112          ?        ? 
1 1 1    4    4   25 o 10.31578 4.565492   13.00798    91.1  0.4510822 1.864473          ?        ? 
1 1 1    4    5    0 x        ?      ?   2248.021     0.0          ?        ?          ?        ? 
1 1 1    4    5    1 o 592.8589 4.481461   995.3785   347.1   3517.539 53.13748          ?        ? 
1 1 1    4    5    2 o 214.7838 1.631131   702.0215   262.7   461.3668 7.006810          ?        ? 
1 1 1    4    5    3 f 260.2145 1.877960   376.2865   235.1   677.2247 9.773447          ?        ? 
1 1 1    4    5    4 o 32.06934 0.5626336   286.4314   132.7   10.28467 0.3608657          ?        ? 
1 1 1    4    5    5 o 143.1052 1.271348   199.0823    32.0   204.8214 3.638730          ?        ? 
1 1 1    4    5    6 o 181.9302 1.405007   201.1904   221.1   331.0342 5.112265          ?        ? 
1 1 1    4    5    7 o 226.7869 1.849782   342.8318   326.3   514.4141 8.390128          ?        ? 
1 1 1    4    5    8 o 202.7869 1.712800   291.7555   177.0   411.2666 6.946666          ?        ? 
1 1 1    4    5    9 o 272.0866 2.193905   296.1323   257.0   740.4664 11.93864          ?        ? 
1 1 1    4    5   10 o 130.8950 1.298045   66.44873    11.5   171.3511 3.398152          ?        ? 
1 1 1    4    5   11 o 237.3456 1.824507   281.8707   260.0   563.4919 8.660777          ?        ? 
1 1 1    4    5   12 o 87.80476 0.9589685   123.0288    65.9   77.10498 1.684040          ?        ? 
1 1 1    4    5   13 o 111.3917 1.079870   132.8502   178.1   124.1077 2.405771          ?        ? 
1 1 1    4    5   14 o 147.6146 1.283440   173.7212   181.7   217.9930 3.789090          ?        ? 
1 1 1    4    5   15 o 148.9466 1.261868   165.4551   238.6   221.9926 3.759018          ?        ? 
1 1 1    4    5   16 o 66.58576 0.9710051   74.50417    78.6   44.35641 1.293102          ?        ? 
1 1 1    4    5   17 o 46.48186 1.164537   28.38342    38.5   21.62187 1.082597          ?        ? 
1 1 1    4    5   18 o 75.89337 1.089666   99.15199   212.8   57.64830 1.653968          ?        ? 
1 1 1    4    5   19 o 55.16416 1.362848   44.89547    66.3   30.49315 1.503607          ?        ? 
1 1 1    4    5   20 o 81.77279 1.121645   89.21237   143.2   67.00074 1.834401          ?        ? 
1 1 1    4    5   21 o 14.84010 4.179505   10.97429    10.6   2.375700 1.293102          ?        ? 
1 1 1    4    5   22 o 23.42281 2.567765   26.96030    53.2   5.623491 1.202886          ?        ? 
1 1 1    4    5   23 o 20.59638 2.993143   21.38509   147.2   4.480750 1.232958          ?        ? 
1 1 1    4    5   24 o 39.14686 2.573430   35.04000   341.9   16.20889 2.014834          ?        ? 
1 1 1    4    5   25 o 29.38190 3.019303   24.99663    10.3   9.653158 1.774257          ?        ? 
1 1 1    4    6    0 o 123.9766 1.625799   407.6963    -0.0   153.7889 4.029667   153.7889 4.029667 
1 1 1    4    6    1 o 196.3002 1.593224   235.0212   296.1   385.3745 6.255006          ?        ? 
1 1 1    4    6    2 o 168.2668 1.385057   115.1721    59.2   283.1593 4.661182          ?        ? 
1 1 1    4    6    3 o 205.6176 1.564904   583.6950    81.1   422.8444 6.435439          ?        ? 
1 1 1    4    6    4 o 266.1213 1.937978   410.1806    46.8   708.4396 10.31474          ?        ? 
1 1 1    4    6    5 o 198.0779 1.647245   192.6166    75.8   392.4415 6.525656          ?        ? 
1 1 1    4    6    6 o 128.4017 1.159308   217.3023   188.8   164.8856 2.977142          ?        ? 
1 1 1    4    6    7 o 191.6804 1.506114   304.5182   255.5   367.4515 5.773852          ?        ? 
1 1 1    4    6    8 o 33.35618 0.9466237   115.4405   314.4   11.12669 0.6315150          ?        ? 
1 1 1    4    6    9 o 307.8261 2.417877   412.6837   184.0   947.8138 14.88571          ?        ? 
1 1 1    4    6   10 f 449.9489 3.351754   471.6977   230.8   2025.870 30.16236          ?        ? 
1 1 1    4    6   11 o 244.1952 2.038099   258.6244   282.4   596.5411 9.953879          ?        ? 
1 1 1    4    6   12 o 42.79202 1.018989   26.15845    16.6   18.31394 0.8720922          ?        ? 
1 1 1    4    6   13 o 182.1708 1.477436   207.1066   123.7   331.9965 5.382914          ?        ? 
1 1 1    4    6   14 o 212.8392 1.646033   237.2921   151.6   453.3376 7.006810          ?        ? 
1 1 1    4    6   15 o 30.37020 1.485279   34.34465   157.5   9.232149 0.9021643          ?        ? 
1 1 1    4    6   16 o 112.9417 1.065050   138.5108   321.5   127.6262 2.405771          ?        ? 
1 1 1    4    6   17 o 178.2817 1.509665   189.0132    71.0   318.2535 5.382914          ?        ? 
1 1 1    4    6   18 o 80.30111 1.029854   93.85142   334.1   64.53483 1.653968          ?        ? 
1 1 1    4    6   19 o 54.66393 1.072749   55.33306     4.5   29.92178 1.172814          ?        ? 
1 1 1    4    6   20 o 30.72726 1.957360   25.87186    18.3   9.502798 1.202886          ?        ? 
1 1 1    4    6   21 o 23.92910 2.199258   22.48252   254.3   5.803924 1.052525          ?        ? 
1 1 1    4    6   22 o 54.90005 1.396792   48.55787    94.6   30.37287 1.533679          ?        ? 
1 1 1    4    6   23 o 24.57500 2.386192   23.81755   107.8   6.255006 1.172814          ?        ? 
1 1 1    4    6   24 o 5.789195 2.891062   7.716855   355.6  -3.368080 1.383319          ?        ? 
1 1 1    4    6   25 o 32.63256 2.442075          ?       ?   11.48756 1.593824          ?        ? 
1 1 1    4    7    0 o 373.1461 3.361249   558.4962   180.0   1393.032 25.08017   1393.032 25.08017 
1 1 1    4    7    1 o 328.5131 2.412083   217.9469   184.8   1079.470 15.84802          ?        ? 
1 1 1    4    7    2 o 150.6935 1.307107   293.3655    25.3   227.1048 3.939451          ?        ? 
1 1 1    4    7    3 o 279.4211 2.055600   614.9830    42.0   781.0037 11.48756          ?        ? 
1 1 1    4    7    4 o 191.5368 1.499393   300.5951    52.5   366.9403 5.743780          ?        ? 
1 1 1    4    7    5 o 137.4928 1.170142   221.0772    17.7   189.0636 3.217719          ?        ? 
1 1 1    4    7    6 o 103.5227 1.031233   245.7211   187.2   107.1771 2.135122          ?        ? 
1 1 1    4    7    7 o 337.7537 2.635457   423.4195   106.2   1141.088 17.80271          ?        ? 
1 1 1    4    7    8 o 278.1223 2.027355   307.8835   325.9   773.6360 11.27705          ?        ? 
1 1 1    4    7    9 f 351.1058 2.740793   357.0013   168.7   1233.168 19.24617          ?        ? 
1 1 1    4    7   10 o 218.6501 1.836099   301.3628   280.7   478.1772 8.029263          ?        ? 
1 1 1    4    7   11 o 141.6783 1.326603   164.9659   158.4   200.7616 3.759018          ?        ? 
1 1 1    4    7   12 o 90.71485 1.176832   96.49585   328.5   82.30746 2.135122          ?        ? 
1 1 1    4    7   13 o 112.4909 1.136151   165.3681   152.3   126.5737 2.556132          ?        ? 
1 1 1    4    7   14 o 51.11261 1.000196   79.87740    65.6   26.13269 1.022453          ?        ? 
1 1 1    4    7   15 o 47.19431 1.051378   83.50453   124.6   22.28346 0.9923807          ?        ? 
1 1 1    4    7   16 o 134.1214 1.199555   143.4721   283.3   180.0119 3.217719          ?        ? 
1 1 1    4    7   17 o 73.95805 1.016527   93.45654    59.8   54.73130 1.503607          ?        ? 
1 1 1    4    7   18 o 26.20480 1.893510   38.37119    61.6   6.886521 0.9923807          ?        ? 
1 1 1    4    7   19 o 93.51249 1.077307   102.6785   346.5   87.57009 2.014834          ?        ? 
1 1 1    4    7   20 o 63.01867 1.169126   59.15071    42.4   39.81552 1.473535          ?        ? 
1 1 1    4    7   21 o 92.65530 1.363149   96.55560   312.5   86.30705 2.526060          ?        ? 
1 1 1    4    7   22 o 10.23382 3.942293   17.46572   167.8  0.8119479 1.142741          ?        ? 
1 1 1    4    7   23 f 25.77744 2.566536   23.17155   347.1   6.916593 1.323174          ?        ? 
1 1 1    4    7   24 o 23.03716 3.328708   23.17950   257.8   5.833996 1.533679          ?        ? 
1 1 1    4    8    0 o 86.57757 1.164072   272.3896   180.0   74.99992 2.014834   74.99992 2.014834 
1 1 1    4    8    1 o 268.1083 1.929223   78.70912   154.1   718.9648 10.34482          ?        ? 
1 1 1    4    8    2 o 240.9095 1.872414   365.9613   235.7   580.5127 9.021644          ?        ? 
1 1 1    4    8    3 o 153.3588 1.294195   293.8199   273.2   235.2243 3.969523          ?        ? 
1 1 1    4    8    4 o 206.5568 1.586906   269.6262   287.8   426.7538 6.555727          ?        ? 
1 1 1    4    8    5 o 28.38838 0.7415181   147.5531    83.2   8.059335 0.4210100          ?        ? 
1 1 1    4    8    6 o 307.2702 2.432038   390.8362   327.5   944.4758 14.94586          ?        ? 
1 1 1    4    8    7 o 126.0767 1.192613   184.8870    45.2   158.9613 3.007215          ?        ? 
1 1 1    4    8    8 o 98.04929 1.027460   81.50100    26.3   96.14065 2.014834          ?        ? 
1 1 1    4    8    9 o 184.1518 1.477872   237.4077   267.2   339.1537 5.443058          ?        ? 
1 1 1    4    8   10 o 136.2959 1.290737   191.5699   216.9   185.7857 3.518441          ?        ? 
1 1 1    4    8   11 o 354.4516 2.757344   341.5859   332.0   1257.316 19.54689          ?        ? 
1 1 1    4    8   12 o 196.9258 1.656882   260.6653   210.8   387.9607 6.525656          ?        ? 
1 1 1    4    8   13 o 225.7624 1.911458   251.4458   131.9   510.0837 8.630706          ?        ? 
1 1 1    4    8   14 o 77.88934 0.9652202   86.37010   310.8   60.68559 1.503607          ?        ? 
1 1 1    4    8   15 o 33.43527 1.304150   30.63037   228.4   11.18684 0.8720922          ?        ? 
1 1 1    4    8   16 o 60.97444 1.011045   79.35410   273.7   37.19924 1.232958          ?        ? 
1 1 1    4    8   17 o 75.20664 0.9996506   95.15660   281.9   56.59578 1.503607          ?        ? 
1 1 1    4    8   18 o 68.70198 1.050525   66.39758   323.5   47.24334 1.443463          ?        ? 
1 1 1    4    8   19 o 71.93052 1.086987   76.78529    48.9   51.81431 1.563751          ?        ? 
1 1 1    4    8   20 o 32.21861 1.586743   28.56015    65.5   10.43503 1.022453          ?        ? 
1 1 1    4    8   21 o 16.31476 3.510599   27.90634    92.6   2.856854 1.112669          ?        ? 
1 1 1    4    8   22 o 17.75090 3.916832   21.27682   156.3   3.488369 1.353247          ?        ? 
1 1 1    4    8   23 o 27.27621 2.866511   29.91449   257.9   7.818758 1.563751          ?        ? 
1 1 1    4    8   24 o 27.78540 2.543405   21.16281   170.1   8.179624 1.413391          ?        ? 
1 1 1    4    9    0 o 201.6427 2.058556   174.9361   180.0   406.7859 8.299912   406.7859 8.299912 
1 1 1    4    9    1 o 438.2738 2.895552   432.2646    31.2   1922.061 25.38089          ?        ? 
1 1 1    4    9    2 o 360.3564 2.424255   584.2983    51.4   1299.237 17.47192          ?        ? 
1 1 1    4    9    3 o 198.0242 1.617319   242.2459   323.7   392.2310 6.405366          ?        ? 
1 1 1    4    9    4 o 124.8633 1.107867   171.5143   294.5   155.9241 2.766637          ?        ? 
1 1 1    4    9    5 o 261.0259 1.947007   310.6195   304.7   681.5250 10.16438          ?        ? 
1 1 1    4    9    6 o 125.2259 1.212723   149.5396    52.3   156.8262 3.037287          ?        ? 
1 1 1    4    9    7 o 320.7368 2.536196   362.3140    49.2   1028.948 16.26903          ?        ? 
1 1 1    4    9    8 o 319.5273 2.503446   392.0565   145.0   1021.250 15.99838          ?        ? 
1 1 1    4    9    9 o 142.3507 1.352025   213.7327   111.4   202.6562 3.849235          ?        ? 
1 1 1    4    9   10 o 99.43275 1.088773   105.7533   294.1   98.87720 2.165194          ?        ? 
1 1 1    4    9   11 o 238.9787 1.981919   203.7883     9.0   571.3407 9.472726          ?        ? 
1 1 1    4    9   12 o 193.4545 1.694385   249.9686    52.1   374.4283 6.555727          ?        ? 
1 1 1    4    9   13 o 70.15227 1.114541   51.82741    45.6   49.22810 1.563751          ?        ? 
1 1 1    4    9   14 o 120.3037 1.199849   150.6474   202.1   144.7974 2.886926          ?        ? 
1 1 1    4    9   15 o 80.44984 0.9531899   100.8125   176.0   64.74533 1.533679          ?        ? 
1 1 1    4    9   16 o 148.2178 1.247783   177.4687    88.8   219.8875 3.698874          ?        ? 
1 1 1    4    9   17 o 70.43689 1.045997   66.92824   259.4   49.64911 1.473535          ?        ? 
1 1 1    4    9   18 o 40.75113 1.254509   52.28355   135.0   16.62990 1.022453          ?        ? 
1 1 1    4    9   19 o 67.09178 1.098149   81.71008    67.1   45.07814 1.473535          ?        ? 
1 1 1    4    9   20 o 38.37611 1.449690   46.17683   141.4   14.79550 1.112669          ?        ? 
1 1 1    4    9   21 f 57.56128 1.253849   59.69283    99.7   33.28986 1.443463          ?        ? 
1 1 1    4    9   22 o 16.03606 4.107453   23.55870   149.1   2.886926 1.323174          ?        ? 
1 1 1    4    9   23 f 27.55639 2.564543   25.66410   212.4   7.908974 1.413391          ?        ? 
1 1 1    4    9   24 o 10.25770 4.122262   14.57584    20.1  0.8720922 1.293102          ?        ? 
1 1 1    4   10    0 o 22.99881 1.050747   150.6307   180.0   5.322770 0.4811543   5.322770 0.4811543 
1 1 1    4   10    1 o 254.0784 1.745777   83.11021   339.8   645.7392 8.871283          ?        ? 
1 1 1    4   10    2 o 63.38326 0.7353964   137.6923   145.2   40.17639 0.9322364          ?        ? 
1 1 1    4   10    3 o 140.4021 1.231569   261.5912   194.7   197.1530 3.458297          ?        ? 
1 1 1    4   10    4 o 368.3380 2.632980   391.8858   196.6   1357.427 19.39653          ?        ? 
1 1 1    4   10    5 o 163.0543 1.374005   297.6371   358.3   265.8979 4.480750          ?        ? 
1 1 1    4   10    6 o 140.3751 1.210383   164.2080   145.1   197.0628 3.398152          ?        ? 
1 1 1    4   10    7 o 406.3069 3.164072   419.6598   349.6   1651.442 25.71168          ?        ? 
1 1 1    4   10    8 o 458.4530 3.430609   480.4870   223.1   2102.885 31.45546          ?        ? 
1 1 1    4   10    9 f 421.9593 3.203491   311.4787   335.1   1781.534 27.03486          ?        ? 
1 1 1    4   10   10 o 74.20025 1.074002   90.62257   330.3   55.06210 1.593824          ?        ? 
1 1 1    4   10   11 o 419.9926 2.928506   480.3231   242.8   1765.596 24.59902          ?        ? 
1 1 1    4   10   12 o 35.10792 1.327673   42.65578   251.4   12.32958 0.9322364          ?        ? 
1 1 1    4   10   13 o 148.8448 1.424360   216.3324   179.2   221.6618 4.240172          ?        ? 
1 1 1    4   10   14 f 67.64146 1.044767   62.67625   129.0   45.76980 1.413391          ?        ? 
1 1 1    4   10   15 o 63.65226 1.086622   62.15847   184.3   40.53725 1.383319          ?        ? 
1 1 1    4   10   16 o 36.68708 1.270524   57.08340    65.4   13.47232 0.9322364          ?        ? 
1 1 1    4   10   17 o 29.60543 1.676012   23.20152   119.1   8.781067 0.9923807          ?        ? 
1 1 1    4   10   18 o 27.81498 1.729839   18.94719    15.6   7.758613 0.9623086          ?        ? 
1 1 1    4   10   19 o 74.64987 1.107817   64.22643     0.6   55.81390 1.653968          ?        ? 
1 1 1    4   10   20 o 16.04786 3.384861   19.98045   350.0   2.736565 1.052525          ?        ? 
1 1 1    4   10   21 o 14.89806 3.737361   18.76138   272.6   2.405771 1.112669          ?        ? 
1 1 1    4   10   22 o 12.74267 4.186162   6.387214   292.9   1.744184 1.232958          ?        ? 
1 1 1    4   10   23 o 33.63061 2.101346   26.54397   260.9   11.63792 1.413391          ?        ? 
1 1 1    4   10   24 o 10.82347 4.326279   14.18945   270.7   1.082597 1.413391          ?        ? 
1 1 1    4   11    0 o 326.9470 3.031282   355.6829     0.0   1069.666 19.81754   1069.666 19.81754 
1 1 1    4   11    1 o 127.0004 1.053706   87.65441   346.6   161.3070 2.676421          ?        ? 
1 1 1    4   11    2 o 168.1268 1.323607   310.5606   354.4   282.7082 4.450677          ?        ? 
1 1 1    4   11    3 f 166.6104 1.299555   149.5580   333.0   277.6260 4.330389          ?        ? 
1 1 1    4   11    4 o 257.5076 1.944413   360.3835   166.1   663.2712 10.01402          ?        ? 
1 1 1    4   11    5 o 502.6083 3.476249   559.9249   126.0   2527.624 34.94383          ?        ? 
1 1 1    4   11    6 o 289.5088 2.176140   362.7432   304.0   838.2911 12.60023          ?        ? 
1 1 1    4   11    7 o 59.26452 1.014845   32.70234    49.6   35.12427 1.202886          ?        ? 
1 1 1    4   11    8 o 392.0362 3.006937   390.2878   120.4   1537.559 23.57656          ?        ? 
1 1 1    4   11    9 o 81.79601 1.066180   37.89956   293.1   66.91052 1.744184          ?        ? 
1 1 1    4   11   10 o 248.6984 2.091884   214.3744   221.7   618.7645 10.40496          ?        ? 
1 1 1    4   11   11 o 108.4810 1.205868   131.6764   162.9   117.7024 2.616277          ?        ? 
1 1 1    4   11   12 o 20.29058 1.926696   18.82480   193.1   4.119884 0.7818757          ?        ? 
1 1 1    4   11   13 f 61.05598 1.083575   50.98783    19.0   37.28946 1.323174          ?        ? 
1 1 1    4   11   14 o 96.42203 1.107176   118.0852   303.7   93.01314 2.135122          ?        ? 
1 1 1    4   11   15 o 34.14202 1.409273   33.13057   258.5   11.66799 0.9623086          ?        ? 
1 1 1    4   11   16 o 25.04565 1.861074   52.86742   211.7   6.285078 0.9322364          ?        ? 
1 1 1    4   11   17 o 87.73893 1.113924   84.09064   132.4   77.04484 1.954689          ?        ? 
1 1 1    4   11   18 o 98.51708 1.068368   85.22245   319.6   97.16310 2.105050          ?        ? 
1 1 1    4   11   19 o 43.84990 1.303015   46.54193   170.4   19.27625 1.142741          ?        ? 
1 1 1    4   11   20 o 29.99243 2.055449   41.67034   104.4   9.081788 1.232958          ?        ? 
1 1 1    4   11   21 o 10.66973 4.062694   24.89556   205.6  0.9021643 1.202886          ?        ? 
1 1 1    4   11   22 o 10.44439 4.040284   18.54810   267.3  0.8720922 1.202886          ?        ? 
1 1 1    4   11   23 o 43.26505 1.772423   46.09979   126.3   19.12588 1.533679          ?        ? 
1 1 1    4   11   24 o 9.272013 3.977847   7.756621   166.2  0.3909379 1.323174          ?        ? 
1 1 1    4   12    0 o 111.7256 1.346242   138.8191   180.0   124.8896 3.007215   124.8896 3.007215 
1 1 1    4   12    1 o 45.45200 0.6616242   35.73378   173.3   20.65956 0.6014429          ?        ? 
1 1 1    4   12    2 o 73.61212 0.7966172   111.6515   260.1   54.19000 1.172814          ?        ? 
1 1 1    4   12    3 o 71.16134 0.7817935   119.1235   321.8   50.64149 1.112669          ?        ? 
1 1 1    4   12    4 o 317.8786 2.142749   339.6652    11.5   1010.725 13.62268          ?        ? 
1 1 1    4   12    5 f 116.8810 1.080612   95.16795   176.1   136.6178 2.526060          ?        ? 
1 1 1    4   12    6 o 186.5626 1.547431   160.0624    19.9   348.0851 5.773852          ?        ? 
1 1 1    4   12    7 o 147.3848 1.397663   252.0064   136.3   217.2412 4.119884          ?        ? 
1 1 1    4   12    8 o 46.30363 1.039129   120.3782    38.9   21.44144 0.9623086          ?        ? 
1 1 1    4   12    9 o 231.6698 1.947091   231.1382   335.0   536.8479 9.021644          ?        ? 
1 1 1    4   12   10 o 341.6173 2.658468   358.6895   336.9   1167.852 18.16358          ?        ? 
1 1 1    4   12   11 o 211.3391 1.878273   227.7774   138.6   446.8721 7.939046          ?        ? 
1 1 1    4   12   12 o 58.80100 1.048416   70.15316   102.6   34.58297 1.232958          ?        ? 
1 1 1    4   12   13 o 111.8958 1.115318   77.37188   253.0   125.2505 2.495988          ?        ? 
1 1 1    4   12   14 o 14.60140 3.177854   8.592001   286.1   2.225339 0.9021643          ?        ? 
1 1 1    4   12   15 o 73.63200 1.143552   90.75672   313.6   54.25015 1.684040          ?        ? 
1 1 1    4   12   16 o 68.95047 1.112160   84.46731   118.7   47.57413 1.533679          ?        ? 
1 1 1    4   12   17 o 70.79472 1.083188   87.93880   283.8   50.16034 1.533679          ?        ? 
1 1 1    4   12   18 o 38.96442 1.504980   43.77844   346.0   15.21651 1.172814          ?        ? 
1 1 1    4   12   19 o 15.88231 3.141258   8.609508    59.8   2.646349 0.9623086          ?        ? 
1 1 1    4   12   20 o 10.31266 3.783882   16.05393   256.7  0.9021643 1.022453          ?        ? 
1 1 1    4   12   21 o 28.14529 2.190345   36.58151   223.0   8.059335 1.232958          ?        ? 
1 1 1    4   12   22 o 43.31103 1.666392   40.52873   292.4   19.03567 1.443463          ?        ? 
1 1 1    4   12   23 o 15.60832 4.021957   12.26775   207.7   2.826782 1.263030          ?        ? 
1 1 1    4   12   24 o 10.50750 4.157749   17.28432   143.7   1.082597 1.293102          ?        ? 
1 1 1    4   13    0 o 69.64463 1.015199   314.2384   180.0   48.53644 1.413391   48.53644 1.413391 
1 1 1    4   13    1 o 179.7699 1.380071   73.65237   274.3   323.2154 4.961904          ?        ? 
1 1 1    4   13    2 o 95.10651 0.8695347   317.2544    50.7   90.45701 1.653968          ?        ? 
1 1 1    4   13    3 o 245.1297 1.772704   233.3992   284.2   600.9918 8.690849          ?        ? 
1 1 1    4   13    4 o 209.6837 1.534559   253.2548   309.7   439.7149 6.435439          ?        ? 
1 1 1    4   13    5 o 686.7139 4.265280   725.1774   236.0   4718.710 58.58054          ?        ? 
1 1 1    4   13    6 o 496.8104 3.422996   504.5880   161.5   2469.344 34.01160          ?        ? 
1 1 1    4   13    7 o 431.5872 3.048414   486.3121   150.6   1863.451 26.31313          ?        ? 
1 1 1    4   13    8 o 58.80513 1.125050   137.0560   112.1   34.58297 1.323174          ?        ? 
1 1 1    4   13    9 o 224.0844 1.945901   249.6343   233.4   502.2950 8.720922          ?        ? 
1 1 1    4   13   10 f 118.2169 1.246468   168.0544    74.2   139.7753 2.947070          ?        ? 
1 1 1    4   13   11 o 157.5463 1.517481   143.3048   269.7   248.3057 4.781471          ?        ? 
1 1 1    4   13   12 o 75.19930 1.119718   46.91154   270.1   56.56570 1.684040          ?        ? 
1 1 1    4   13   13 o 47.60714 1.168595   70.90121   136.4   22.67440 1.112669          ?        ? 
1 1 1    4   13   14 o 52.87259 1.023779   30.53858   191.5   27.96709 1.082597          ?        ? 
1 1 1    4   13   15 o 27.34566 1.649557   39.01535   262.5   7.487964 0.9021643          ?        ? 
1 1 1    4   13   16 o 114.1465 1.304089   122.0753   260.8   130.4229 2.977142          ?        ? 
1 1 1    4   13   17 o 148.4584 1.579990   127.8611   263.5   220.8197 4.691255          ?        ? 
1 1 1    4   13   18 o 107.9189 1.184284   90.33205   107.5   116.6498 2.556132          ?        ? 
1 1 1    4   13   19 o 36.27464 1.450773   38.34804   275.9   13.20167 1.052525          ?        ? 
1 1 1    4   13   20 o 62.26543 1.183269   67.58508   238.4   38.91335 1.473535          ?        ? 
1 1 1    4   13   21 o 32.15294 1.823805   25.24232   222.5   10.46511 1.172814          ?        ? 
1 1 1    4   13   22 o 28.63183 2.153125   19.40231   234.1   8.420200 1.232958          ?        ? 
1 1 1    4   13   23 o 38.59328 1.909057   39.01594   344.7   15.33679 1.473535          ?        ? 
1 1 1    4   13   24 o 8.777390 3.870283   8.452486   307.1  0.1202886 1.323174          ?        ? 
1 1 1    4   14    0 o 256.4294 2.562981   455.0239   180.0   657.8883 13.14153   657.8883 13.14153 
1 1 1    4   14    1 o 284.6887 1.943623   324.6114    61.6   810.6548 11.06655          ?        ? 
1 1 1    4   14    2 o 113.8572 0.9772495   102.4979    67.0   129.6410 2.225339          ?        ? 
1 1 1    4   14    3 o 161.8737 1.291139   240.9765    68.6   262.0487 4.180028          ?        ? 
1 1 1    4   14    4 o 538.8179 3.421235   609.7633    66.2   2904.428 36.86845          ?        ? 
1 1 1    4   14    5 o 105.8938 0.9939439   81.25262   307.2   112.1390 2.105050          ?        ? 
1 1 1    4   14    6 o 412.0321 2.959539   424.8825   131.9   1698.354 24.38851          ?        ? 
1 1 1    4   14    7 o 230.0859 1.797120   282.6414   196.2   529.4802 8.269840          ?        ? 
1 1 1    4   14    8 o 288.8353 2.389444   237.3147    62.4   834.5621 13.80311          ?        ? 
1 1 1    4   14    9 o 271.5746 2.236798   327.8032   216.5   737.8802 12.14915          ?        ? 
1 1 1    4   14   10 o 65.57224 1.077736   26.93502    64.9   43.00317 1.413391          ?        ? 
1 1 1    4   14   11 o 24.39220 2.034218   15.15665   186.4   5.954284 0.9923807          ?        ? 
1 1 1    4   14   12 o 149.4592 1.428565   177.8071   292.3   223.4962 4.270245          ?        ? 
1 1 1    4   14   13 o 144.8009 1.443371   192.3845   224.2   209.8134 4.180028          ?        ? 
1 1 1    4   14   14 o 175.5121 1.653426   194.5294   198.4   308.3898 5.803924          ?        ? 
1 1 1    4   14   15 o 75.22628 1.039365   77.77323   197.2   56.62585 1.563751          ?        ? 
1 1 1    4   14   16 o 41.77814 1.259660   37.75069   276.4   17.47192 1.052525          ?        ? 
1 1 1    4   14   17 o 79.62086 1.038653   80.14687    47.3   63.45222 1.653968          ?        ? 
1 1 1    4   14   18 o 83.76968 0.9333636   82.80604   221.4   70.24854 1.563751          ?        ? 
1 1 1    4   14   19 o 20.10151 2.543224   13.31545    57.4   4.089812 1.022453          ?        ? 
1 1 1    4   14   20 o 24.06222 2.124602   37.81038   109.2   5.864068 1.022453          ?        ? 
1 1 1    4   14   21 o 22.87251 2.432329   33.87710    56.6   5.352841 1.112669          ?        ? 
1 1 1    4   14   22 o 20.43614 2.648733   16.44854    70.0   4.360461 1.082597          ?        ? 
1 1 1    4   14   23 f 11.82774 4.030102   6.151788   130.5   1.563751 1.142741          ?        ? 
1 1 1    4   14   24 o 13.34764 4.227238   9.655878   141.9   2.255411 1.263030          ?        ? 
1 1 1    4   15    0 o 19.01054 1.686118   5.246489     0.0   3.698874 0.6315150   3.698874 0.6315150 
1 1 1    4   15    1 o 179.2390 1.358992   111.3767   263.2   321.2908 4.871688          ?        ? 
1 1 1    4   15    2 o 463.3231 2.842854   562.1747   235.4   2147.332 26.34320          ?        ? 
1 1 1    4   15    3 o 128.8257 1.155493   188.8696   273.0   165.9682 2.977142          ?        ? 
1 1 1    4   15    4 o 412.7757 2.691936   484.4349   155.1   1704.279 22.22332          ?        ? 
1 1 1    4   15    5 o 114.2790 1.078902   147.7912    97.2   130.6033 2.465916          ?        ? 
1 1 1    4   15    6 o 438.4589 2.853178   461.8096    59.7   1923.174 25.02002          ?        ? 
1 1 1    4   15    7 o 468.9062 3.293206   480.3419   215.5   2200.108 30.88409          ?        ? 
1 1 1    4   15    8 o 177.1002 1.672560   177.7306   263.6   313.7126 5.924213          ?        ? 
1 1 1    4   15    9 o 176.0546 1.699574   185.0503   224.2   310.0438 5.984357          ?        ? 
1 1 1    4   15   10 o 209.3616 1.838558   280.6961    31.2   438.5421 7.698469          ?        ? 
1 1 1    4   15   11 o 148.8120 1.475195   165.9963   168.8   221.5415 4.390533          ?        ? 
1 1 1    4   15   12 o 79.15206 1.101793   62.54490   314.7   62.67035 1.744184          ?        ? 
1 1 1    4   15   13 o 72.15437 1.083615   73.34457   161.1   52.08495 1.563751          ?        ? 
1 1 1    4   15   14 o 31.09773 1.643935   32.38131   300.1   9.683230 1.022453          ?        ? 
1 1 1    4   15   15 o 10.50563 3.580840   2.964500   212.2   1.022453 0.9021643          ?        ? 
1 1 1    4   15   16 o 27.66071 1.848205   23.19562   351.0   7.668397 1.022453          ?        ? 
1 1 1    4   15   17 o 105.3512 1.113242   109.4125    93.6   111.1166 2.345627          ?        ? 
1 1 1    4   15   18 o 27.58043 1.853585   9.547558   311.5   7.638325 1.022453          ?        ? 
1 1 1    4   15   19 o 72.05961 1.064174   58.55500    61.8   52.05489 1.533679          ?        ? 
1 1 1    4   15   20 o 18.42363 2.530002   26.06388   290.2   3.458297 0.9322364          ?        ? 
1 1 1    4   15   21 o 31.25159 1.683955   29.73613   122.0   9.893736 1.052525          ?        ? 
1 1 1    4   15   22 o 24.08939 2.247042   21.92255   130.2   5.984357 1.082597          ?        ? 
1 1 1    4   15   23 o 42.94348 1.400545   36.06998   343.9   18.76502 1.202886          ?        ? 
1 1 1    4   16    0 o 152.0474 1.721193   341.9441   180.0   231.2849 5.232553   231.2849 5.232553 
1 1 1    4   16    1 o 226.8432 1.617330   240.7549    99.5   514.6246 7.337603          ?        ? 
1 1 1    4   16    2 o 80.22021 0.8434574   85.98268   232.9   64.35439 1.353247          ?        ? 
1 1 1    4   16    3 o 307.8234 2.022242   489.8960   107.3   947.6935 12.44987          ?        ? 
1 1 1    4   16    4 o 281.5582 1.997275   410.2578   188.9   792.8822 11.24698          ?        ? 
1 1 1    4   16    5 o 318.5418 2.185491   427.3073   231.7   1014.905 13.92340          ?        ? 
1 1 1    4   16    6 o 219.7544 1.642132   255.1988    27.7   482.9887 7.217315          ?        ? 
1 1 1    4   16    7 o 259.8137 1.840346   333.8602    85.4   675.1797 9.562942          ?        ? 
1 1 1    4   16    8 o 52.70915 1.255166   91.66920   265.2   27.78666 1.323174          ?        ? 
1 1 1    4   16    9 o 247.2088 2.110571   273.0945    17.2   611.4268 10.43503          ?        ? 
1 1 1    4   16   10 o 144.2383 1.501123   188.4284   357.4   208.1293 4.330389          ?        ? 
1 1 1    4   16   11 o 53.18624 1.243907   73.17512   128.3   28.29789 1.323174          ?        ? 
1 1 1    4   16   12 f 37.42245 1.446454   29.02601   271.1   14.01362 1.082597          ?        ? 
1 1 1    4   16   13 o 79.67135 1.170102   91.07429   351.3   63.51237 1.864473          ?        ? 
1 1 1    4   16   14 o 113.9640 1.240208   81.94748   281.1   129.9718 2.826782          ?        ? 
1 1 1    4   16   15 o 127.2139 1.359245   127.9924   347.5   161.9986 3.458297          ?        ? 
1 1 1    4   16   16 o 97.62524 1.124334   88.97594   255.9   95.38885 2.195267          ?        ? 
1 1 1    4   16   17 o 66.53532 1.152530   76.57143    16.4   44.32634 1.533679          ?        ? 
1 1 1    4   16   18 o 37.41562 1.486905   35.00407   244.1   14.04369 1.112669          ?        ? 
1 1 1    4   16   19 o 68.52444 1.141017   62.84672   200.2   47.09298 1.563751          ?        ? 
1 1 1    4   16   20 o 22.25474 2.094467   24.74745   262.7   5.022048 0.9322364          ?        ? 
1 1 1    4   16   21 o 72.36636 1.142774   67.89889    15.1   52.71647 1.653968          ?        ? 
1 1 1    4   16   22 o 51.72598 1.279023   54.33331   256.4   27.03486 1.323174          ?        ? 
1 1 1    4   16   23 o 8.927729 3.601519   9.159849   322.0  0.5713707 0.9923807          ?        ? 
1 1 1    4   17    0 o 461.5820 4.137783   549.3915     0.0   2131.754 38.19162   2131.754 38.19162 
1 1 1    4   17    1 o 403.5420 2.567231   368.0598   174.7   1628.858 20.71971          ?        ? 
1 1 1    4   17    2 o 102.7812 0.9362689   139.2542   131.4   105.6434 1.924617          ?        ? 
1 1 1    4   17    3 o 168.4102 1.303524   220.7935   111.0   283.6405 4.390533          ?        ? 
1 1 1    4   17    4 o 296.6944 2.123436   331.3493   189.6   880.4523 12.60023          ?        ? 
1 1 1    4   17    5 o 592.8329 3.748664   533.1898   117.2   3516.998 44.44663          ?        ? 
1 1 1    4   17    6 o 193.0682 1.503076   125.9160   236.3   372.8044 5.803924          ?        ? 
1 1 1    4   17    7 o 209.3067 1.566057   186.1880    91.5   438.1812 6.555727          ?        ? 
1 1 1    4   17    8 o 203.5143 1.706678   226.3566   180.1   414.3039 6.946666          ?        ? 
1 1 1    4   17    9 o 177.5842 1.684934   195.1754    61.9   315.4869 5.984357          ?        ? 
1 1 1    4   17   10 o 151.6235 1.497424   180.4875   178.3   229.9918 4.540894          ?        ? 
1 1 1    4   17   11 o 196.9812 1.763281   228.4284    44.7   388.3216 6.946666          ?        ? 
1 1 1    4   17   12 o 101.2985 1.261684   101.8588   308.8   102.6663 2.556132          ?        ? 
1 1 1    4   17   13 o 160.9725 1.559909   187.4339   271.5   259.3723 5.022048          ?        ? 
1 1 1    4   17   14 o 58.63099 1.205328   55.65570   248.6   34.40253 1.413391          ?        ? 
1 1 1    4   17   15 o 97.50037 1.233724   83.20070   291.0   95.14826 2.405771          ?        ? 
1 1 1    4   17   16 o 55.61927 1.297628   67.46207     0.2   30.97431 1.443463          ?        ? 
1 1 1    4   17   17 o 41.50313 1.412922   55.03586   294.1   17.26141 1.172814          ?        ? 
1 1 1    4   17   18 o 21.70021 2.425149   21.87691   261.6   4.751399 1.052525          ?        ? 
1 1 1    4   17   19 o 40.41955 1.450800   40.25500   283.1   16.41939 1.172814          ?        ? 
1 1 1    4   17   20 o 32.40869 1.484646   38.12849     6.4   10.58539 0.9623086          ?        ? 
1 1 1    4   17   21 o 44.94545 1.338162   43.12967   287.1   20.38891 1.202886          ?        ? 
1 1 1    4   17   22 o 15.87434 3.327192   16.28110    75.9   2.796710 1.022453          ?        ? 
1 1 1    4   17   23 o 15.51893 3.561504   15.12407   140.0   2.826782 1.082597          ?        ? 
1 1 1    4   18    0 o 42.27651 1.282979   259.3760   180.0   17.92300 1.082597   17.92300 1.082597 
1 1 1    4   18    1 o 305.9336 2.000330   245.6417   175.3   936.1158 12.23936          ?        ? 
1 1 1    4   18    2 o 244.2876 1.717265   272.6471   201.7   596.8419 8.390128          ?        ? 
1 1 1    4   18    3 o 211.1263 1.516951   210.5549   228.9   445.7895 6.405366          ?        ? 
1 1 1    4   18    4 o 355.8577 2.438001   367.0244   252.3   1266.729 17.35163          ?        ? 
1 1 1    4   18    5 o 127.8979 1.187387   60.80789   253.1   163.5925 3.037287          ?        ? 
1 1 1    4   18    6 o 78.41761 0.9778922   64.01523   250.8   61.49754 1.533679          ?        ? 
1 1 1    4   18    7 f 155.7494 1.351562   162.5601   229.8   242.6221 4.210100          ?        ? 
1 1 1    4   18    8 o 97.64533 1.077906   100.0108   295.6   95.35877 2.105050          ?        ? 
1 1 1    4   18    9 o 127.0834 1.277819   140.2765   326.6   161.5476 3.247792          ?        ? 
1 1 1    4   18   10 o 88.81909 1.117306   121.7510   200.8   78.90931 1.984761          ?        ? 
1 1 1    4   18   11 o 37.86197 1.509089   57.39193   262.9   14.34441 1.142741          ?        ? 
1 1 1    4   18   12 o 52.89657 1.250719   59.73504   155.0   27.99717 1.323174          ?        ? 
1 1 1    4   18   13 o 63.36280 1.210236   86.25876    61.4   40.17639 1.533679          ?        ? 
1 1 1    4   18   14 o 161.0989 1.577352   152.2644   252.8   259.9135 5.082192          ?        ? 
1 1 1    4   18   15 f 101.5197 1.303367   87.84893   127.5   103.1775 2.646349          ?        ? 
1 1 1    4   18   16 o 64.63139 1.279539   55.84482   270.0   41.83036 1.653968          ?        ? 
1 1 1    4   18   17 o 45.23303 1.396137   36.42529   307.8   20.50920 1.263030          ?        ? 
1 1 1    4   18   18 o 36.38139 1.570503   41.35229    38.0   13.29189 1.142741          ?        ? 
1 1 1    4   18   19 o 31.70901 1.707082   35.46422    42.0   10.13431 1.082597          ?        ? 
1 1 1    4   18   20 o 28.28230 2.020241   27.13841    95.9   8.119479 1.142741          ?        ? 
1 1 1    4   18   21 f 5.401038 2.644622   8.264585   211.6  -1.774257 0.9623086          ?        ? 
1 1 1    4   18   22 o 12.30679 3.786120   15.76928    71.4   1.714112 1.022453          ?        ? 
1 1 1    4   18   23 o 9.002959 3.645843   13.96240    78.9  0.6315150 1.022453          ?        ? 
1 1 1    4   19    0 o 40.60234 1.336348   63.49672   360.0   16.53968 1.082597   16.53968 1.082597 
1 1 1    4   19    1 o 97.71141 0.9386831   123.8065    70.0   95.47906 1.834401          ?        ? 
1 1 1    4   19    2 o 32.06866 1.172178   70.54124   196.9   10.28467 0.7518036          ?        ? 
1 1 1    4   19    3 o 169.5295 1.321525   242.0328   290.8   287.4296 4.480750          ?        ? 
1 1 1    4   19    4 o 166.8106 1.334051   149.6630   111.2   278.2876 4.450677          ?        ? 
1 1 1    4   19    5 o 230.3077 1.756217   156.9936    55.2   530.5328 8.089407          ?        ? 
1 1 1    4   19    6 o 170.9437 1.398551   171.0170   356.6   292.2712 4.781471          ?        ? 
1 1 1    4   19    7 o 149.4755 1.247343   114.5930    36.2   223.4661 3.728946          ?        ? 
1 1 1    4   19    8 o 157.0778 1.359277   214.7740   225.3   246.8021 4.270245          ?        ? 
1 1 1    4   19    9 o 87.67916 1.131832   134.0079    58.3   76.89447 1.984761          ?        ? 
1 1 1    4   19   10 o 144.0575 1.325569   145.9758   171.1   207.6181 3.819162          ?        ? 
1 1 1    4   19   11 o 85.57198 1.124560   110.4129   186.4   73.25574 1.924617          ?        ? 
1 1 1    4   19   12 o 80.79498 1.191050   113.8881   178.8   65.31670 1.924617          ?        ? 
1 1 1    4   19   13 o 77.29337 1.206102   90.53561   129.3   59.78342 1.864473          ?        ? 
1 1 1    4   19   14 o 75.17826 1.240035   90.37109    58.2   56.56570 1.864473          ?        ? 
1 1 1    4   19   15 o 29.18292 2.060942   13.35510   296.2   8.540489 1.202886          ?        ? 
1 1 1    4   19   16 o 67.44932 1.226082   59.22855   332.7   45.55930 1.653968          ?        ? 
1 1 1    4   19   17 o 55.56300 1.380126   64.94463    20.6   30.94424 1.533679          ?        ? 
1 1 1    4   19   18 o 53.91689 1.254938   72.41515    67.2   29.16998 1.353247          ?        ? 
1 1 1    4   19   19 o 17.44344 3.130596   12.03850   123.6   3.217719 1.052525          ?        ? 
1 1 1    4   19   20 o 54.56699 1.295097   56.12021   184.6   29.98193 1.413391          ?        ? 
1 1 1    4   19   21 f 25.20228 2.088155   9.774097    86.5   6.525656 1.052525          ?        ? 
1 1 1    4   19   22 o 31.58177 1.904399   36.27182   285.5   10.28467 1.202886          ?        ? 
1 1 1    4   19   23 o 31.10899 1.885008   32.27665   309.2   10.10424 1.172814          ?        ? 
1 1 1    4   20    0 o 180.1775 1.894818   134.5924    -0.0   324.7792 6.826377   324.7792 6.826377 
1 1 1    4   20    1 o 185.6071 1.369072   174.6318   296.3   344.5366 5.082192          ?        ? 
1 1 1    4   20    2 o 252.2566 1.734542   278.3390   243.4   636.4468 8.750995          ?        ? 
1 1 1    4   20    3 o 119.3743 1.032850   63.69762   199.3   142.5119 2.465916          ?        ? 
1 1 1    4   20    4 o 433.1875 2.700462   458.4123    67.2   1877.524 23.39613          ?        ? 
1 1 1    4   20    5 o 338.3273 2.342114   351.2189    32.3   1145.238 15.84802          ?        ? 
1 1 1    4   20    6 o 174.3718 1.431417   206.1336   137.3   304.1196 4.991976          ?        ? 
1 1 1    4   20    7 o 124.8942 1.191866   109.2143   316.7   156.0143 2.977142          ?        ? 
1 1 1    4   20    8 o 140.7554 1.239160   174.1968   270.9   198.1754 3.488369          ?        ? 
1 1 1    4   20    9 o 112.4737 1.203168   141.3587   184.1   126.5436 2.706493          ?        ? 
1 1 1    4   20   10 o 148.1842 1.420563   166.6655   176.5   219.7071 4.210100          ?        ? 
1 1 1    4   20   11 o 56.28742 1.095234   78.61759   198.4   31.69604 1.232958          ?        ? 
1 1 1    4   20   12 o 154.3967 1.431574   193.0347   244.2   238.5924 4.420605          ?        ? 
1 1 1    4   20   13 o 62.08589 1.283564   47.82780   193.2   38.58256 1.593824          ?        ? 
1 1 1    4   20   14 o 17.68678 3.268418   41.81643    71.2   3.247792 1.112669          ?        ? 
1 1 1    4   20   15 o 13.45412 4.278934   36.00675     8.9   1.804329 1.293102          ?        ? 
1 1 1    4   20   16 o 74.50589 1.291587   70.27968    70.2   55.60339 1.924617          ?        ? 
1 1 1    4   20   17 o 28.28698 2.179374   40.86495    56.9   8.059335 1.232958          ?        ? 
1 1 1    4   20   18 f 69.89443 1.226215   82.41677    92.3   49.01760 1.714112          ?        ? 
1 1 1    4   20   19 o 26.29490 2.058569   30.26229   154.8   7.006810 1.082597          ?        ? 
1 1 1    4   20   20 o 51.11259 1.382625   48.81491   350.5   26.37327 1.413391          ?        ? 
1 1 1    4   20   21 o 22.71669 2.449013   28.18361   176.1   5.352841 1.112669          ?        ? 
1 1 1    4   20   22 o 24.59869 2.200518   22.20270    91.4   6.315150 1.082597          ?        ? 
1 1 1    4   21    0 o 388.7247 3.590240   277.7193     0.0   1512.088 27.90695   1512.088 27.90695 
1 1 1    4   21    1 o 334.4071 2.149249   366.1552    89.9   1118.624 14.37449          ?        ? 
1 1 1    4   21    2 o 573.4468 3.471596   579.6330   348.0   3291.246 39.81552          ?        ? 
1 1 1    4   21    3 o 253.0961 1.794138   216.3411   119.3   640.7472 9.081788          ?        ? 
1 1 1    4   21    4 o 177.9849 1.334776   192.3897   317.8   316.8401 4.751399          ?        ? 
1 1 1    4   21    5 o 76.65159 1.020039   59.21170   229.1   58.76097 1.563751          ?        ? 
1 1 1    4   21    6 o 281.7428 2.065345   342.7481   173.9   794.2053 11.63792          ?        ? 
1 1 1    4   21    7 o 30.67426 1.470556   43.67797   164.7   9.412581 0.9021643          ?        ? 
1 1 1    4   21    8 o 13.28454 3.470755   15.14859   278.8   1.834401 0.9322364          ?        ? 
1 1 1    4   21    9 o 12.68572 3.616066   26.74048   261.4   1.653968 0.9623086          ?        ? 
1 1 1    4   21   10 o 102.1596 1.148021   78.26337   210.7   104.4105 2.345627          ?        ? 
1 1 1    4   21   11 o 154.0384 1.415381   198.2749   293.9   237.4797 4.360461          ?        ? 
1 1 1    4   21   12 o 94.88946 1.140904   90.62366   116.4   90.09615 2.165194          ?        ? 
1 1 1    4   21   13 o 92.96346 1.148366   112.4123    77.0   86.48749 2.135122          ?        ? 
1 1 1    4   21   14 o 78.05934 1.155742   88.85302   233.4   60.98631 1.804329          ?        ? 
1 1 1    4   21   15 o 42.91847 1.681634   35.82709   344.5   18.46430 1.443463          ?        ? 
1 1 1    4   21   16 o 22.77845 2.640403   29.03901   170.4   5.232553 1.202886          ?        ? 
1 1 1    4   21   17 o 68.65314 1.226484   60.71178   299.6   47.24334 1.684040          ?        ? 
1 1 1    4   21   18 o 7.913167 3.532052   2.257878    52.8 -0.4210100 1.142741          ?        ? 
1 1 1    4   21   19 o 44.79420 1.409814   47.10701   246.9   20.20848 1.263030          ?        ? 
1 1 1    4   21   20 o 36.53047 1.646414   31.56593   232.3   13.53246 1.202886          ?        ? 
1 1 1    4   21   21 o 29.98231 2.005992   26.94240   359.7   9.232149 1.202886          ?        ? 
1 1 1    4   21   22 o 24.89531 2.174300   15.31910   218.4   6.495584 1.082597          ?        ? 
1 1 1    4   22    0 o 234.1220 2.331822   383.5089   180.0   548.4257 10.91619   548.4257 10.91619 
1 1 1    4   22    1 o 178.8777 1.386954   218.4882   107.4   320.0277 4.961904          ?        ? 
1 1 1    4   22    2 o 16.89760 2.402553   77.54807    90.6   2.856854 0.8119479          ?        ? 
1 1 1    4   22    3 o 242.5590 1.667513   245.8839    28.0   588.5119 8.089407          ?        ? 
1 1 1    4   22    4 o 130.4560 1.071898   160.8288   301.0   170.2083 2.796710          ?        ? 
1 1 1    4   22    5 o 46.43112 1.101043   61.51630   198.8   21.56173 1.022453          ?        ? 
1 1 1    4   22    6 o 63.80472 1.036894   74.04344   306.5   40.71768 1.323174          ?        ? 
1 1 1    4   22    7 o 117.5743 1.163760   129.2023    14.7   138.2717 2.736565          ?        ? 
1 1 1    4   22    8 o 50.01274 1.082321   81.02466   174.2   25.02002 1.082597          ?        ? 
1 1 1    4   22    9 o 78.07924 1.116932   87.18375    46.5   60.98631 1.744184          ?        ? 
1 1 1    4   22   10 o 127.0859 1.301457   120.2163   179.0   161.6077 3.307936          ?        ? 
1 1 1    4   22   11 o 54.65722 1.182920   56.50245    64.5   29.89171 1.293102          ?        ? 
1 1 1    4   22   12 o 37.12805 1.579417   33.42788   129.2   13.80311 1.172814          ?        ? 
1 1 1    4   22   13 o 59.66788 1.285180   76.13578   280.4   35.63549 1.533679          ?        ? 
1 1 1    4   22   14 o 84.78991 1.188133   90.28291   204.8   71.96265 2.014834          ?        ? 
1 1 1    4   22   15 o 128.6799 1.285335   127.7347   275.5   165.8479 3.307936          ?        ? 
1 1 1    4   22   16 o 64.22217 1.217455   67.52786   253.0   41.31913 1.563751          ?        ? 
1 1 1    4   22   17 o 15.57100 3.103500   19.00641    74.0   2.556132 0.9322364          ?        ? 
1 1 1    4   22   18 o 25.15425 2.450794   21.74299   278.9   6.435439 1.232958          ?        ? 
1 1 1    4   22   19 o 38.85514 1.780098   40.33463   105.4   15.27665 1.383319          ?        ? 
1 1 1    4   22   20 o 33.81754 1.867419   33.88364   237.8   11.66799 1.263030          ?        ? 
1 1 1    4   22   21 o 15.60033 3.790836   22.58147   204.9   2.796710 1.172814          ?        ? 
1 1 1    4   22   22 o 31.52213 2.003402   29.08018   163.4   10.40496 1.263030          ?        ? 
1 1 1    4   23    0 o 133.6693 1.631608   49.85868     0.0   178.7789 4.360461   178.7789 4.360461 
1 1 1    4   23    1 f 190.8929 1.402054   170.6040    40.2   364.4744 5.352841          ?        ? 
1 1 1    4   23    2 o 314.0921 2.101561   330.3668   174.5   986.9979 13.20167          ?        ? 
1 1 1    4   23    3 o 287.8780 1.937759   290.2960   236.6   829.0891 11.15676          ?        ? 
1 1 1    4   23    4 o 55.56991 0.9740857   67.42869   106.3   30.88409 1.082597          ?        ? 
1 1 1    4   23    5 o 260.6948 1.943712   254.6718   239.9   680.0515 10.13431          ?        ? 
1 1 1    4   23    6 o 253.6802 1.902623   223.9478    20.4   643.9649 9.653158          ?        ? 
1 1 1    4   23    7 o 63.68444 1.038852   90.05013   166.9   40.56732 1.323174          ?        ? 
1 1 1    4   23    8 o 96.00665 1.080643   68.98405    28.6   92.20119 2.074978          ?        ? 
1 1 1    4   23    9 f 138.3932 1.227716   163.6673   175.6   191.6197 3.398152          ?        ? 
1 1 1    4   23   10 o 113.8736 1.294010   118.3194   275.5   129.7613 2.947070          ?        ? 
1 1 1    4   23   11 o 60.79793 1.187099   43.88503   170.9   36.98874 1.443463          ?        ? 
1 1 1    4   23   12 o 82.77399 1.108078   69.57609   346.6   68.56449 1.834401          ?        ? 
1 1 1    4   23   13 o 104.4885 1.208774   93.61987    45.4   109.2822 2.526060          ?        ? 
1 1 1    4   23   14 o 73.45173 1.166829   84.23136   112.3   54.00957 1.714112          ?        ? 
1 1 1    4   23   15 o 70.57613 1.235676   66.89164   294.8   49.88969 1.744184          ?        ? 
1 1 1    4   23   16 o 47.41380 1.458772   50.83584    32.7   22.55411 1.383319          ?        ? 
1 1 1    4   23   17 o 13.94325 3.708770   7.903680    69.4   2.074978 1.052525          ?        ? 
1 1 1    4   23   18 o 73.26115 1.149341   70.26875   265.0   53.88928 1.684040          ?        ? 
1 1 1    4   23   19 o 46.11735 1.434574   49.78832   323.3   21.47151 1.323174          ?        ? 
1 1 1    4   23   20 o 24.14862 2.241530   27.11024    95.4   6.014429 1.082597          ?        ? 
1 1 1    4   23   21 f 19.26950 2.653034   17.94292   349.3   3.939451 1.022453          ?        ? 
1 1 1    4   23   22 o 7.908772 3.392633   8.145033   323.9  0.2105050 0.9623086          ?        ? 
1 1 1    4   24    0 o 301.3975 2.814226   340.0924    -0.0   909.0809 16.96069   909.0809 16.96069 
1 1 1    4   24    1 o 23.45417 1.795033   21.24775   235.5   5.503202 0.8420200          ?        ? 
1 1 1    4   24    2 o 102.8926 1.022935   101.1271   122.1   105.8840 2.105050          ?        ? 
1 1 1    4   24    3 o 287.9494 1.926835   264.8557    48.0   829.6304 11.09662          ?        ? 
1 1 1    4   24    4 o 148.7437 1.172611   138.0535    52.0   221.3009 3.488369          ?        ? 
1 1 1    4   24    5 f 206.3601 1.661283   212.5322    70.4   426.0622 6.856449          ?        ? 
1 1 1    4   24    6 o 166.6937 1.362047   193.2928   264.9   277.9869 4.540894          ?        ? 
1 1 1    4   24    7 o 74.15318 1.034129   77.45776   233.9   55.00195 1.533679          ?        ? 
1 1 1    4   24    8 o 67.84116 1.041691   41.19608   198.3   46.04045 1.413391          ?        ? 
1 1 1    4   24    9 o 124.5058 1.207661   103.0684   210.9   155.1121 3.007215          ?        ? 
1 1 1    4   24   10 o 93.40314 1.207353   85.31219   170.6   87.29943 2.255411          ?        ? 
1 1 1    4   24   11 o 10.20460 3.822292   21.94729    81.1  0.7818757 1.052525          ?        ? 
1 1 1    4   24   12 o 61.67642 1.218948   61.18443    47.9   38.07133 1.503607          ?        ? 
1 1 1    4   24   13 o 34.20922 1.802084   3.518892   349.1   11.72814 1.232958          ?        ? 
1 1 1    4   24   14 o 57.12778 1.316003   73.59435   180.2   32.68842 1.503607          ?        ? 
1 1 1    4   24   15 o 84.54701 1.173762   73.74594   296.0   71.60178 1.984761          ?        ? 
1 1 1    4   24   16 o 30.97768 1.892998   23.10845    21.1   9.653158 1.172814          ?        ? 
1 1 1    4   24   17 o 66.75090 1.193859   68.55576   134.8   44.71728 1.593824          ?        ? 
1 1 1    4   24   18 f 23.14542 2.468613   26.74065   200.7   5.473131 1.142741          ?        ? 
1 1 1    4   24   19 o 5.539221 2.727991   17.78092   351.7  -2.225339 1.082597          ?        ? 
1 1 1    4   24   20 o 27.83595 2.106653   28.14811    46.3   7.969118 1.172814          ?        ? 
1 1 1    4   24   21 o 27.33483 2.035259   24.95472   274.1   7.758613 1.112669          ?        ? 
1 1 1    4   25    0 o 174.4064 1.957584   175.5500    -0.0   304.3903 6.826377   304.3903 6.826377 
1 1 1    4   25    1 o 221.7380 1.579975   254.5430   237.5   491.8900 7.006810          ?        ? 
1 1 1    4   25    2 o 137.2420 1.194191   125.7282   215.6   188.4020 3.277864          ?        ? 
1 1 1    4   25    3 o 221.6539 1.580575   199.7572   255.8   491.5292 7.006810          ?        ? 
1 1 1    4   25    4 o 93.90648 1.008740   89.41508    41.2   88.20160 1.894545          ?        ? 
1 1 1    4   25    5 o 173.1804 1.554135   144.3639    60.5   300.0899 5.382914          ?        ? 
1 1 1    4   25    6 o 36.11736 1.415459   84.44030   326.2   13.05131 1.022453          ?        ? 
1 1 1    4   25    7 o 122.0977 1.280738   111.5259   295.3   149.1578 3.127503          ?        ? 
1 1 1    4   25    8 o 99.30745 1.120429   89.39355    43.1   98.66671 2.225339          ?        ? 
1 1 1    4   25    9 o 93.04136 1.082762   86.33108   141.3   86.60778 2.014834          ?        ? 
1 1 1    4   25   10 o 77.17901 1.149442   69.81448    91.9   59.60299 1.774257          ?        ? 
1 1 1    4   25   11 o 63.54799 1.206710   60.11148   191.6   40.41696 1.533679          ?        ? 
1 1 1    4   25   12 o 14.06838 4.053508   13.62964    65.3   2.044906 1.202886          ?        ? 
1 1 1    4   25   13 o 54.68987 1.347174   53.96774   183.7   29.95186 1.473535          ?        ? 
1 1 1    4   25   14 o 21.43229 2.876403   19.29251    63.4   4.631110 1.232958          ?        ? 
1 1 1    4   25   15 o 26.95242 2.064136   17.31211    91.0   7.307531 1.112669          ?        ? 
1 1 1    4   25   16 o 91.86635 1.178448   98.76110    14.2   84.65308 2.165194          ?        ? 
1 1 1    4   25   17 o 55.31253 1.386376   56.30710    19.4   30.76381 1.533679          ?        ? 
1 1 1    4   25   18 o 30.99557 1.940416   32.80337    40.7   9.743376 1.202886          ?        ? 
1 1 1    4   25   19 o 16.69558 3.449674   7.331821   102.4   3.067359 1.112669          ?        ? 
1 1 1    4   25   20 o 25.60704 2.231303   23.63184   345.8   6.796305 1.142741          ?        ? 
1 1 1    4   25   21 o 23.78540 2.275760   23.00984   101.8   5.984357 1.082597          ?        ? 
1 1 1    4   26    0 o 8.279832 4.568182   45.91560     0.0  0.9623086 1.082597  0.9623086 1.082597 
1 1 1    4   26    1 o 106.3378 1.060493   100.4658   105.5   113.1013 2.255411          ?        ? 
1 1 1    4   26    2 o 160.5093 1.292746   109.4053    82.3   257.7183 4.149956          ?        ? 
1 1 1    4   26    3 o 128.6338 1.157216   124.4063   301.8   165.5171 2.977142          ?        ? 
1 1 1    4   26    4 f 105.2697 1.014120   121.3662   169.7   110.8459 2.135122          ?        ? 
1 1 1    4   26    5 o 66.56974 0.9712388   66.85246    14.4   44.32634 1.293102          ?        ? 
1 1 1    4   26    6 o 46.51963 1.260558   61.49566   131.1   21.65195 1.172814          ?        ? 
1 1 1    4   26    7 o 167.4371 1.571523   170.2156   334.2   280.6032 5.262625          ?        ? 
1 1 1    4   26    8 o 59.14942 1.118502   58.30166    20.7   35.00398 1.323174          ?        ? 
1 1 1    4   26    9 o 132.7701 1.211764   141.4656    27.8   176.4032 3.217719          ?        ? 
1 1 1    4   26   10 o 77.24602 1.226306   89.39725    57.2   59.72328 1.894545          ?        ? 
1 1 1    4   26   11 o 95.64949 1.241878   90.12509   314.1   91.56968 2.375700          ?        ? 
1 1 1    4   26   12 o 95.71553 1.303857   71.19490    11.8   91.72004 2.495988          ?        ? 
1 1 1    4   26   13 o 24.39780 2.403523   21.69205   246.2   5.984357 1.172814          ?        ? 
1 1 1    4   26   14 o 86.74735 1.230656   66.86758   142.8   75.39087 2.135122          ?        ? 
1 1 1    4   26   15 o 35.92038 1.716237   45.32298   136.2   12.96109 1.232958          ?        ? 
1 1 1    4   26   16 o 34.80878 1.814240   31.74595   358.3   12.20929 1.263030          ?        ? 
1 1 1    4   26   17 o 26.57670 2.036741   21.85293   194.3   7.157170 1.082597          ?        ? 
1 1 1    4   26   18 o 25.16022 2.330691   31.97944   172.7   6.495584 1.172814          ?        ? 
1 1 1    4   26   19 o 36.14709 1.663877   35.56292   241.5   13.29189 1.202886          ?        ? 
1 1 1    4   26   20 o 30.73905 1.907693   27.41989   230.9   9.743376 1.172814          ?        ? 
1 1 1    4   26   21 o 23.53537 2.299936   22.25663    64.1   5.894140 1.082597          ?        ? 
1 1 1    4   27    0 o 196.6606 2.064849   188.8105   180.0   387.0886 8.119479   387.0886 8.119479 
1 1 1    4   27    1 o 48.02029 1.001981   55.35815    82.7   23.06533 0.9623086          ?        ? 
1 1 1    4   27    2 o 209.9710 1.496654   192.4986   199.3   441.1283 6.285078          ?        ? 
1 1 1    4   27    3 o 132.6591 1.133437   127.8282   126.2   176.0423 3.007215          ?        ? 
1 1 1    4   27    4 o 170.0685 1.326178   187.6341   276.1   289.3842 4.510822          ?        ? 
1 1 1    4   27    5 o 126.4840 1.093671   130.6765   109.9   160.0440 2.766637          ?        ? 
1 1 1    4   27    6 o 91.09884 1.122356   109.7232   266.6   83.02919 2.044906          ?        ? 
1 1 1    4   27    7 o 77.32270 1.030631   96.77259   325.9   59.81350 1.593824          ?        ? 
1 1 1    4   27    8 o 186.1906 1.469766   177.8987   349.9   347.0326 5.473131          ?        ? 
1 1 1    4   27    9 o 131.2133 1.226141   125.7906   343.5   172.3134 3.217719          ?        ? 
1 1 1    4   27   10 o 58.36898 1.313779   68.04192   287.4   34.10181 1.533679          ?        ? 
1 1 1    4   27   11 o 36.33572 1.820763   19.24600   324.0   13.23174 1.323174          ?        ? 
1 1 1    4   27   12 o 59.39865 1.366947   32.32373   130.8   35.33477 1.623896          ?        ? 
1 1 1    4   27   13 o 43.33049 1.630943   26.48650   213.0   18.82516 1.413391          ?        ? 
1 1 1    4   27   14 o 69.46486 1.255444   75.42898   330.8   48.35601 1.744184          ?        ? 
1 1 1    4   27   15 o 32.45003 1.946116   47.21384   263.6   10.61547 1.263030          ?        ? 
1 1 1    4   27   16 o 62.43672 1.252269   67.00426    19.6   39.15393 1.563751          ?        ? 
1 1 1    4   27   17 o 16.77663 3.767201   13.64169   210.9   3.067359 1.232958          ?        ? 
1 1 1    4   27   18 o 29.24656 2.107868   29.98329   135.9   8.750995 1.232958          ?        ? 
1 1 1    4   27   19 o 14.10573 3.841193   12.46071    33.1   2.255411 1.112669          ?        ? 
1 1 1    4   27   20 o 9.993722 3.923029   11.53743   295.6  0.8720922 1.142741          ?        ? 
1 1 1    4   27   21 o 9.753293 3.923239   11.69301   329.0  0.8720922 1.172814          ?        ? 
1 1 1    4   28    0 o 86.25864 1.430252   90.04748   180.0   74.48870 2.465916   74.48870 2.465916 
1 1 1    4   28    1 o 253.7031 1.926159   224.7584    48.8   644.3558 9.773447          ?        ? 
1 1 1    4   28    2 o 154.3773 1.256437   169.5952   149.6   238.4420 3.879307          ?        ? 
1 1 1    4   28    3 o 220.0372 1.571687   194.4191   294.7   484.5525 6.916593          ?        ? 
1 1 1    4   28    4 o 19.67903 2.292197   33.86195   309.5   3.879307 0.9021643          ?        ? 
1 1 1    4   28    5 o 162.5664 1.267139   168.2054   286.6   264.4544 4.119884          ?        ? 
1 1 1    4   28    6 o 160.4820 1.302335   170.9354   185.4   257.7183 4.180028          ?        ? 
1 1 1    4   28    7 o 95.14628 1.058808   115.9808     9.9   90.57730 2.014834          ?        ? 
1 1 1    4   28    8 o 69.45313 1.060813   87.77062   338.3   48.26579 1.473535          ?        ? 
1 1 1    4   28    9 o 58.73433 1.152006   67.10845   165.8   34.52282 1.353247          ?        ? 
1 1 1    4   28   10 o 113.1689 1.235635   100.7126     2.3   128.1976 2.796710          ?        ? 
1 1 1    4   28   11 o 14.98487 4.097816   18.96523    27.4   2.345627 1.263030          ?        ? 
1 1 1    4   28   12 o 42.84208 1.684632   41.40338   206.2   18.40415 1.443463          ?        ? 
1 1 1    4   28   13 o 56.96887 1.451642   56.93868   208.4   32.53806 1.653968          ?        ? 
1 1 1    4   28   14 o 39.56567 1.748130   35.35138   282.7   15.72773 1.383319          ?        ? 
1 1 1    4   28   15 o 62.16753 1.281878   67.34640   237.5   38.79307 1.593824          ?        ? 
1 1 1    4   28   16 o 25.38747 2.369054   44.41334   189.0   6.555727 1.202886          ?        ? 
1 1 1    4   28   17 o 34.52514 1.829146   39.29671   231.0   12.08900 1.263030          ?        ? 
1 1 1    4   28   18 o 19.35960 3.106691   20.21589   306.2   3.969523 1.202886          ?        ? 
1 1 1    4   28   19 o 12.08824 4.030096   8.204582   148.3   1.623896 1.142741          ?        ? 
1 1 1    4   28   20 o 27.41782 2.303301   27.48948    58.7   7.969118 1.263030          ?        ? 
1 1 1    4   29    0 o 105.3710 1.556152   140.0077     0.0   111.1467 3.277864   111.1467 3.277864 
1 1 1    4   29    1 o 111.4519 1.025323   123.9875   339.0   124.2581 2.285483          ?        ? 
1 1 1    4   29    2 o 44.81023 1.107315   55.73301   157.7   20.08819 0.9923807          ?        ? 
1 1 1    4   29    3 o 189.2606 1.422091   171.4453   204.2   358.4900 5.382914          ?        ? 
1 1 1    4   29    4 o 51.02048 1.031473   76.95792   121.3   26.04248 1.052525          ?        ? 
1 1 1    4   29    5 o 76.97397 0.9571645   82.37966   308.6   59.27220 1.473535          ?        ? 
1 1 1    4   29    6 o 43.92371 1.198129   45.75317    84.6   19.30632 1.052525          ?        ? 
1 1 1    4   29    7 o 33.29098 1.535631   30.19599    77.5   11.09662 1.022453          ?        ? 
1 1 1    4   29    8 o 198.9874 1.594378   196.4639    99.5   396.5313 6.345222          ?        ? 
1 1 1    4   29    9 o 22.43493 2.479770   22.63174    18.4   5.052120 1.112669          ?        ? 
1 1 1    4   29   10 o 171.2166 1.545614   132.5816   119.2   293.6244 5.292697          ?        ? 
1 1 1    4   29   11 o 69.16351 1.282654   54.98774   179.2   47.90493 1.774257          ?        ? 
1 1 1    4   29   12 o 158.6216 1.450318   157.2172   151.6   252.1850 4.601038          ?        ? 
1 1 1    4   29   13 o 103.9410 1.273005   109.3276   178.9   108.2898 2.646349          ?        ? 
1 1 1    4   29   14 o 7.800918 3.555234   13.20057   338.0 -0.7518036 1.232958          ?        ? 
1 1 1    4   29   15 o 49.89422 1.506795   39.18621   352.2   25.05010 1.503607          ?        ? 
1 1 1    4   29   16 o 50.54216 1.457729   53.51097   223.1   25.74175 1.473535          ?        ? 
1 1 1    4   29   17 o 57.59637 1.383615   51.92943   315.7   33.50037 1.593824          ?        ? 
1 1 1    4   29   18 o 56.60197 1.381358   47.68871   345.5   32.41777 1.563751          ?        ? 
1 1 1    4   29   19 o 32.55249 1.939990   33.59130     0.4   10.94626 1.263030          ?        ? 
1 1 1    4   29   20 o 30.53829 2.166419   32.69180    20.4   9.863664 1.323174          ?        ? 
1 1 1    4   30    0 o 5.121667 3.535633   58.65533   180.0 -0.7217315 1.142741 -0.7217315 1.142741 
1 1 1    4   30    1 o 52.73068 0.9980196   70.34258    31.0   27.81673 1.052525          ?        ? 
1 1 1    4   30    2 o 99.04071 0.9412659   89.98001    93.3   98.12540 1.864473          ?        ? 
1 1 1    4   30    3 o 109.8984 1.039816   95.91123    65.6   120.8299 2.285483          ?        ? 
1 1 1    4   30    4 o 80.42847 0.9534431   67.81363   249.9   64.71526 1.533679          ?        ? 
1 1 1    4   30    5 o 130.1155 1.097815   153.9166   219.7   169.3964 2.856854          ?        ? 
1 1 1    4   30    6 o 107.4784 1.119189   105.4171   328.2   115.5973 2.405771          ?        ? 
1 1 1    4   30    7 o 115.9350 1.167246   123.2983   206.4   134.5127 2.706493          ?        ? 
1 1 1    4   30    8 o 90.91882 1.157654   74.39573   213.2   82.72847 2.105050          ?        ? 
1 1 1    4   30    9 o 28.34882 2.068541   19.27779   260.6   8.059335 1.172814          ?        ? 
1 1 1    4   30   10 o 118.2468 1.398742   123.2285   286.5   140.0460 3.307936          ?        ? 
1 1 1    4   30   11 o 68.14655 1.345924   48.92877   312.2   46.52161 1.834401          ?        ? 
1 1 1    4   30   12 o 66.77782 1.328477   55.84362    37.4   44.68721 1.774257          ?        ? 
1 1 1    4   30   13 o 24.00681 2.755831   40.03950   280.8   5.833996 1.323174          ?        ? 
1 1 1    4   30   14 o 39.65785 1.819896   37.98134    13.8   15.84802 1.443463          ?        ? 
1 1 1    4   30   15 o 36.54668 1.892537   32.91416    16.5   13.50239 1.383319          ?        ? 
1 1 1    4   30   16 o 9.234463 3.895646   13.73046   247.2  0.2105050 1.232958          ?        ? 
1 1 1    4   30   17 f 55.08955 1.364694   47.47015   305.6   30.67359 1.503607          ?        ? 
1 1 1    4   30   18 f 11.28082 4.153615   15.63134    10.1   1.263030 1.232958          ?        ? 
1 1 1    4   30   19 o 12.98009 4.236904   6.466715    98.2   2.014834 1.263030          ?        ? 
1 1 1    4   31    0 o 27.69824 2.367452   19.39693     0.0   7.848830 1.293102   7.848830 1.293102 
1 1 1    4   31    1 o 117.1094 1.052826   113.3672   303.1   137.2192 2.465916          ?        ? 
1 1 1    4   31    2 o 84.70624 0.9407948   57.90588   287.8   71.78221 1.593824          ?        ? 
1 1 1    4   31    3 o 123.8799 1.092386   131.2019   300.4   153.5484 2.706493          ?        ? 
1 1 1    4   31    4 o 70.20887 1.006562   57.52581   193.4   49.31832 1.413391          ?        ? 
1 1 1    4   31    5 o 92.37117 0.9929510   105.4162   213.9   85.37482 1.834401          ?        ? 
1 1 1    4   31    6 o 161.4409 1.378423   168.5233    10.4   260.9059 4.450677          ?        ? 
1 1 1    4   31    7 o 133.8539 1.179486   108.9294   205.4   179.3202 3.157575          ?        ? 
1 1 1    4   31    8 o 75.85140 1.189384   64.77688   284.7   57.58816 1.804329          ?        ? 
1 1 1    4   31    9 o 19.62724 2.987720   44.88342   261.4   3.879307 1.172814          ?        ? 
1 1 1    4   31   10 o 146.0284 1.266492   145.5371   330.6   213.5724 3.698874          ?        ? 
1 1 1    4   31   11 o 91.88735 1.243633   97.40050   105.6   84.59294 2.285483          ?        ? 
1 1 1    4   31   12 o 10.76618 4.109151   19.92711    90.7  0.8420200 1.232958          ?        ? 
1 1 1    4   31   13 f 86.43462 1.252504   97.27734   319.2   74.96986 2.165194          ?        ? 
1 1 1    4   31   14 o 7.950147 3.645319   15.56814   196.0 -0.8720922 1.323174          ?        ? 
1 1 1    4   31   15 o 30.20572 2.040935   28.58796   308.5   9.262220 1.232958          ?        ? 
1 1 1    4   31   16 o 35.14938 1.967771   31.94514   227.4   12.60023 1.383319          ?        ? 
1 1 1    4   31   17 o 27.34097 2.474760   27.22758   251.7   7.758613 1.353247          ?        ? 
1 1 1    4   31   18 o 24.16147 2.675960   29.05691   334.7   6.194862 1.293102          ?        ? 
1 1 1    4   31   19 o 34.74120 2.077452   30.02411     4.4   12.69044 1.443463          ?        ? 
1 1 1    4   32    0 o 129.7316 1.611587   64.25274   180.0   168.4942 4.180028   168.4942 4.180028 
1 1 1    4   32    1 o 127.0376 1.088905   133.7535   207.3   161.4874 2.766637          ?        ? 
1 1 1    4   32    2 o 135.6051 1.208606   134.2287   293.1   184.0415 3.277864          ?        ? 
1 1 1    4   32    3 o 27.55943 1.691320   6.859648   163.1   7.608253 0.9322364          ?        ? 
1 1 1    4   32    4 f 107.9955 1.099907   90.54186    18.3   116.7100 2.375700          ?        ? 
1 1 1    4   32    5 o 141.2093 1.192584   133.9597   321.2   199.5587 3.368080          ?        ? 
1 1 1    4   32    6 o 49.81250 1.297970   37.37750   141.9   24.83959 1.293102          ?        ? 
1 1 1    4   32    7 o 59.18323 1.270298   81.65244   147.8   35.06412 1.503607          ?        ? 
1 1 1    4   32    8 o 63.91127 1.270430   57.17993    78.1   40.89812 1.623896          ?        ? 
1 1 1    4   32    9 o 116.3717 1.149944   108.2507   254.1   135.5953 2.676421          ?        ? 
1 1 1    4   32   10 o 58.44416 1.260635   60.40226   355.6   34.22210 1.473535          ?        ? 
1 1 1    4   32   11 o 74.21407 1.296666   71.24888    40.7   55.21246 1.924617          ?        ? 
1 1 1    4   32   12 o 31.86408 2.217844   40.30677   229.2   10.25460 1.413391          ?        ? 
1 1 1    4   32   13 f 52.44297 1.548249   39.84659   309.5   27.66637 1.623896          ?        ? 
1 1 1    4   32   14 o 41.75327 1.692551   40.95688   275.7   17.59221 1.413391          ?        ? 
1 1 1    4   32   15 o 50.86771 1.537077   52.60975   289.1   26.13269 1.563751          ?        ? 
1 1 1    4   32   16 o 18.27355 3.667383   11.77414   340.5   3.698874 1.293102          ?        ? 
1 1 1    4   32   17 o 28.81135 2.400649   28.48302   259.7   8.630706 1.383319          ?        ? 
1 1 1    4   32   18 o 22.46942 2.877472   17.56462   228.5   5.443058 1.293102          ?        ? 
1 1 1    4   32   19 o 24.88092 2.598582   25.74996   322.5   6.736160 1.293102          ?        ? 
1 1 1    4   33    0 f 22.22445 2.921455  0.4855097   360.0   5.202481 1.263030   5.202481 1.263030 
1 1 1    4   33    1 o 50.65911 1.127874   44.03384   160.4   25.68161 1.142741          ?        ? 
1 1 1    4   33    2 o 13.66886 3.416064   33.26043   111.2   1.954689 0.9322364          ?        ? 
1 1 1    4   33    3 f 49.60920 1.151744   35.71269   274.1   24.62909 1.142741          ?        ? 
1 1 1    4   33    4 o 107.1545 1.094507   91.63005     4.5   114.9057 2.345627          ?        ? 
1 1 1    4   33    5 f 94.15401 1.038028   110.2572    66.3   88.71283 1.954689          ?        ? 
1 1 1    4   33    6 o 66.18638 1.135889   81.19645   140.5   43.84519 1.503607          ?        ? 
1 1 1    4   33    7 o 19.84666 3.106210   38.98940    81.3   3.969523 1.232958          ?        ? 
1 1 1    4   33    8 o 69.68053 1.251558   50.54541   226.1   48.62666 1.744184          ?        ? 
1 1 1    4   33    9 f 125.8263 1.230836   107.5176   197.3   158.6005 3.097431          ?        ? 
1 1 1    4   33   10 o 97.97344 1.197073   91.77928   263.8   96.17072 2.345627          ?        ? 
1 1 1    4   33   11 o 55.52245 1.489459   52.69603   282.8   30.94424 1.653968          ?        ? 
1 1 1    4   33   12 o 87.73409 1.268229   78.99209   257.8   77.25534 2.225339          ?        ? 
1 1 1    4   33   13 f 62.44916 1.468716   63.37309   130.7   39.24415 1.834401          ?        ? 
1 1 1    4   33   14 o 8.516828 3.724230   3.420813   172.6 -0.1503607 1.202886          ?        ? 
1 1 1    4   33   15 o 37.21001 1.899208   29.90108    46.8   14.10384 1.413391          ?        ? 
1 1 1    4   33   16 o 32.59839 2.306260   26.92514   327.7   10.97633 1.503607          ?        ? 
1 1 1    4   33   17 o 16.32571 3.988844   18.80725    52.4   3.127503 1.293102          ?        ? 
1 1 1    4   33   18 o 36.07922 2.083758   27.70762   201.1   13.68283 1.503607          ?        ? 
1 1 1    4   34    0 o 45.22793 1.767859   19.20292   180.0   20.56935 1.593824   20.56935 1.593824 
1 1 1    4   34    1 o 139.8063 1.236817   130.0707   200.8   195.6494 3.458297          ?        ? 
1 1 1    4   34    2 o 13.27545 3.633200   19.59818    26.8   1.834401 0.9923807          ?        ? 
1 1 1    4   34    3 o 100.4086 1.048242   86.40014   299.5   100.8920 2.105050          ?        ? 
1 1 1    4   34    4 o 77.98822 1.041116   79.54837   173.8   60.86602 1.623896          ?        ? 
1 1 1    4   34    5 o 52.45330 1.261288   31.39443   138.8   27.54608 1.323174          ?        ? 
1 1 1    4   34    6 o 71.21182 1.076843   67.83816   130.7   50.76178 1.533679          ?        ? 
1 1 1    4   34    7 o 52.29682 1.322565   47.34604   283.1   27.39572 1.383319          ?        ? 
1 1 1    4   34    8 o 73.18208 1.212221   46.00307   109.3   53.64870 1.774257          ?        ? 
1 1 1    4   34    9 o 29.60090 2.082636   28.23006   223.4   8.811138 1.232958          ?        ? 
1 1 1    4   34   10 o 88.67860 1.203854   93.81103   201.0   78.81909 2.135122          ?        ? 
1 1 1    4   34   11 o 18.13361 3.847907   10.34870   172.2   3.518441 1.353247          ?        ? 
1 1 1    4   34   12 o 13.96982 4.249830   19.37356   286.9   2.074978 1.293102          ?        ? 
1 1 1    4   34   13 o 40.35946 1.825514   33.83995    31.6   16.47953 1.473535          ?        ? 
1 1 1    4   34   14 o 20.81516 3.178392   27.25591   256.1   4.540894 1.323174          ?        ? 
1 1 1    4   34   15 o 35.72025 1.936323   35.70855   180.1   13.05131 1.383319          ?        ? 
1 1 1    4   34   16 o 35.63607 1.983090   27.62016   179.2   13.05131 1.413391          ?        ? 
1 1 1    4   34   17 o 23.08858 2.865430   20.67455   119.9   5.743780 1.323174          ?        ? 
1 1 1    4   34   18 o 17.34871 3.829410   21.38453    30.9   3.668802 1.293102          ?        ? 
1 1 1    4   35    0 o 40.05975 1.923712   24.75376   180.0   16.17881 1.533679   16.17881 1.533679 
1 1 1    4   35    1 o 90.50432 1.079887   65.21970   210.1   81.97667 1.954689          ?        ? 
1 1 1    4   35    2 o 92.59116 1.023070   85.94144   272.1   85.79582 1.894545          ?        ? 
1 1 1    4   35    3 o 65.61881 1.031142   70.57927    28.6   43.09338 1.353247          ?        ? 
1 1 1    4   35    4 o 51.11986 1.176535   40.44475   227.3   26.16277 1.202886          ?        ? 
1 1 1    4   35    5 o 15.68310 3.535861   12.18596   255.3   2.586205 1.082597          ?        ? 
1 1 1    4   35    6 o 94.46611 1.098266   73.05828   273.7   89.34435 2.074978          ?        ? 
1 1 1    4   35    7 f 67.79140 1.219895   36.53974   262.1   46.04045 1.653968          ?        ? 
1 1 1    4   35    8 o 49.44476 1.368443   31.44150   227.8   24.50880 1.353247          ?        ? 
1 1 1    4   35    9 o 30.19185 1.992071   43.59579    59.4   9.172004 1.202886          ?        ? 
1 1 1    4   35   10 o 64.68339 1.232019   66.31404    28.4   41.98072 1.593824          ?        ? 
1 1 1    4   35   11 o 42.86325 1.753959   32.12252   338.0   18.52444 1.503607          ?        ? 
1 1 1    4   35   12 o 27.28885 2.589686   25.77093   119.1   7.608253 1.413391          ?        ? 
1 1 1    4   35   13 o 31.05982 2.372092   28.20349   101.2   9.863664 1.473535          ?        ? 
1 1 1    4   35   14 o 35.50722 1.990286   22.81158   127.1   12.87088 1.413391          ?        ? 
1 1 1    4   35   15 o 14.90493 4.300974   6.658823    97.1   2.556132 1.353247          ?        ? 
1 1 1    4   35   16 o 23.02213 3.004325   27.61399    14.7   5.713707 1.383319          ?        ? 
1 1 1    4   35   17 o 16.57142 4.100196   14.43024   177.3   3.398152 1.353247          ?        ? 
1 1 1    4   36    0 o 64.52610 1.469741   49.10080   180.0   41.74014 1.894545   41.74014 1.894545 
1 1 1    4   36    1 o 58.95161 1.147760   41.93279    66.4   34.79347 1.353247          ?        ? 
1 1 1    4   36    2 o 80.12709 1.013325   57.05976    69.4   64.26418 1.623896          ?        ? 
1 1 1    4   36    3 o 74.36833 1.031137   58.60969   116.7   55.36282 1.533679          ?        ? 
1 1 1    4   36    4 f 63.41755 1.114353   48.19396     7.6   40.26660 1.413391          ?        ? 
1 1 1    4   36    5 o 62.86174 1.148125   83.97746   305.0   39.57494 1.443463          ?        ? 
1 1 1    4   36    6 o 115.8845 1.167754   105.8873   255.6   134.5127 2.706493          ?        ? 
1 1 1    4   36    7 o 76.12231 1.204903   72.41998    48.7   58.06931 1.834401          ?        ? 
1 1 1    4   36    8 o 69.17977 1.173678   54.70589   145.8   47.96507 1.623896          ?        ? 
1 1 1    4   36    9 o 70.51686 1.215392   61.67263    96.0   49.88969 1.714112          ?        ? 
1 1 1    4   36   10 o 16.13225 3.710111   20.66084    94.9   2.796710 1.172814          ?        ? 
1 1 1    4   36   11 o 42.84533 1.719599   45.55725    50.6   18.52444 1.473535          ?        ? 
1 1 1    4   36   12 o 10.72052 4.180384   13.12912   226.5  0.8420200 1.293102          ?        ? 
1 1 1    4   36   13 o 26.66488 2.650286   23.46413   325.0   7.367675 1.413391          ?        ? 
1 1 1    4   36   14 o 11.37628 4.383950   14.90849   132.4   1.142741 1.413391          ?        ? 
1 1 1    4   36   15 o 30.76732 2.345773   24.41642   326.6   9.863664 1.443463          ?        ? 
1 1 1    4   36   16 o 19.88805 3.841678   16.89873    39.6   4.631110 1.473535          ?        ? 
1 1 1    4   36   17 o 15.38816 4.256501   3.987713   173.9   3.037287 1.353247          ?        ? 
1 1 1    4   37    0 o 64.80719 1.603062   43.06062   180.0   42.13108 2.074978   42.13108 2.074978 
1 1 1    4   37    1 o 50.93460 1.210334   44.71763   193.1   25.98233 1.232958          ?        ? 
1 1 1    4   37    2 o 71.43761 1.031344   53.30719   107.8   51.09257 1.473535          ?        ? 
1 1 1    4   37    3 o 143.3199 1.185513   126.7119   139.6   205.7536 3.398152          ?        ? 
1 1 1    4   37    4 o 115.5677 1.118913   89.99458   164.5   133.7609 2.586205          ?        ? 
1 1 1    4   37    5 o 92.27576 1.108041   69.80031   120.3   85.28461 2.044906          ?        ? 
1 1 1    4   37    6 o 73.98559 1.158409   36.20367   224.9   54.85159 1.714112          ?        ? 
1 1 1    4   37    7 o 56.95845 1.267119   48.97793   269.6   32.53806 1.443463          ?        ? 
1 1 1    4   37    8 o 61.17916 1.253433   53.28245   101.0   37.56011 1.533679          ?        ? 
1 1 1    4   37    9 o 14.58584 4.137952   11.61134   222.5   2.285483 1.263030          ?        ? 
1 1 1    4   37   10 o 9.662613 3.971961   19.08940   122.7  0.3909379 1.232958          ?        ? 
1 1 1    4   37   11 o 12.71038 4.382757   14.67338    77.1   1.623896 1.353247          ?        ? 
1 1 1    4   37   12 o 35.76281 2.018106   46.10362    97.8   13.05131 1.443463          ?        ? 
1 1 1    4   37   13 o 27.87398 2.589266   26.41880     9.3   8.089407 1.443463          ?        ? 
1 1 1    4   37   14 o 25.41104 2.781056   27.69309   154.3   6.796305 1.413391          ?        ? 
1 1 1    4   37   15 f 15.04637 4.350682   12.09828   165.3   2.736565 1.383319          ?        ? 
1 1 1    4   37   16 o 28.98335 2.593916   22.25860   100.7   9.081788 1.503607          ?        ? 
1 1 1    4   38    0 f 80.65606 1.436468   80.21105    -0.0   65.19641 2.315555   65.19641 2.315555 
1 1 1    4   38    1 o 44.50392 1.317652   50.19524   251.0   19.84762 1.172814          ?        ? 
1 1 1    4   38    2 o 83.17612 1.084643   73.02180   252.5   69.28622 1.804329          ?        ? 
1 1 1    4   38    3 o 47.01958 1.311111   19.89841    89.9   22.16317 1.232958          ?        ? 
1 1 1    4   38    4 o 50.52729 1.249849   44.51709    20.0   25.59139 1.263030          ?        ? 
1 1 1    4   38    5 o 97.04682 1.100048   89.68329   131.0   94.36639 2.135122          ?        ? 
1 1 1    4   38    6 o 81.76840 1.084928   67.41507    87.4   67.03081 1.774257          ?        ? 
1 1 1    4   38    7 o 51.21966 1.350379   52.02134    64.0   26.34320 1.383319          ?        ? 
1 1 1    4   38    8 o 91.70233 1.180556   71.89121    27.7   84.41251 2.165194          ?        ? 
1 1 1    4   38    9 o 36.32375 1.779968   41.42659    69.1   13.32196 1.293102          ?        ? 
1 1 1    4   38   10 o 54.20797 1.275936   46.66053   248.0   29.56092 1.383319          ?        ? 
1 1 1    4   38   11 o 43.85349 1.748640   37.96779   300.0   19.51682 1.533679          ?        ? 
1 1 1    4   38   12 o 17.74055 4.350004   7.954259   303.6   3.608657 1.533679          ?        ? 
1 1 1    4   38   13 o 23.65044 3.178814   22.93261   230.3   5.954284 1.503607          ?        ? 
1 1 1    4   38   14 o 24.00168 3.069650   9.426426   299.1   6.224934 1.473535          ?        ? 
1 1 1    4   38   15 o 36.57434 2.096660   31.61090   269.0   14.04369 1.533679          ?        ? 
1 1 1    4   39    0 o 73.70725 1.510994   57.46047   180.0   54.49073 2.225339   54.49073 2.225339 
1 1 1    4   39    1 o 20.26667 2.596690   16.81104    98.2   4.149956 1.052525          ?        ? 
1 1 1    4   39    2 o 68.90813 1.091023   49.32782   175.5   47.57413 1.503607          ?        ? 
1 1 1    4   39    3 o 16.91274 3.227334   32.75331   335.4   3.007215 1.052525          ?        ? 
1 1 1    4   39    4 o 33.11432 1.725449   29.66289    48.3   11.03648 1.142741          ?        ? 
1 1 1    4   39    5 o 17.03843 3.294504   16.41719   284.4   3.067359 1.082597          ?        ? 
1 1 1    4   39    6 o 50.66991 1.246331   47.98126    17.7   25.77183 1.263030          ?        ? 
1 1 1    4   39    7 o 11.89226 4.220912   14.16906   165.0   1.323174 1.263030          ?        ? 
1 1 1    4   39    8 o 76.38498 1.259814   64.34410   273.0   58.64068 1.924617          ?        ? 
1 1 1    4   39    9 o 59.66512 1.285240   37.90950   147.2   35.81593 1.533679          ?        ? 
1 1 1    4   39   10 o 20.19438 3.127182   24.22136   215.1   4.270245 1.263030          ?        ? 
1 1 1    4   39   11 o 22.68539 3.247762   21.70123   330.3   5.443058 1.473535          ?        ? 
1 1 1    4   39   12 o 32.63763 2.211348   29.97590    73.5   10.97633 1.443463          ?        ? 
1 1 1    4   39   13 o 24.59236 2.934779   24.94947   285.0   6.465511 1.443463          ?        ? 
1 1 1    4   39   14 o 12.98415 4.434075   13.17789   261.3   2.014834 1.383319          ?        ? 
1 1 1    4   39   15 o 10.61624 4.264761   17.52871    22.4   1.112669 1.383319          ?        ? 
1 1 1    4   40    0 o 14.78470 5.416807   18.46818   180.0   2.977142 1.473535   2.977142 1.473535 
1 1 1    4   40    1 o 17.56250 3.200686   18.16825    22.4   3.247792 1.082597          ?        ? 
1 1 1    4   40    2 o 20.79654 2.602830   3.789139   133.3   4.390533 1.082597          ?        ? 
1 1 1    4   40    3 o 53.21454 1.243245   55.93326   161.6   28.41818 1.323174          ?        ? 
1 1 1    4   40    4 o 26.27579 2.060066   32.42949   203.2   6.976738 1.082597          ?        ? 
1 1 1    4   40    5 o 12.21266 3.918344   14.65653   332.6   1.533679 1.082597          ?        ? 
1 1 1    4   40    6 o 16.99862 3.213022   16.72358   227.9   3.067359 1.052525          ?        ? 
1 1 1    4   40    7 o 27.24757 2.207327   28.44380   217.5   7.548109 1.202886          ?        ? 
1 1 1    4   40    8 o 25.29799 2.555742   19.32665   282.1   6.555727 1.293102          ?        ? 
1 1 1    4   40    9 o 55.96018 1.370331   59.44279   288.0   31.60582 1.533679          ?        ? 
1 1 1    4   40   10 o 53.14810 1.442836   46.65916   225.3   28.56854 1.533679          ?        ? 
1 1 1    4   40   11 o 11.49374 4.466491   11.38787   281.8   1.142741 1.473535          ?        ? 
1 1 1    4   40   12 o 8.806649 3.949225   1.956965    88.2 -0.3007214 1.443463          ?        ? 
1 1 1    4   40   13 o 22.38585 3.358388   23.44775   161.2   5.533275 1.503607          ?        ? 
1 1 1    4   40   14 o 15.02618 4.585003   9.012391   117.3   2.947070 1.503607          ?        ? 
1 1 1    4   41    0 o 74.44659 1.698524   53.54811   180.0   55.72369 2.526060   55.72369 2.526060 
1 1 1    4   41    1 o 58.86575 1.226064   40.40735   102.0   34.79347 1.443463          ?        ? 
1 1 1    4   41    2 o 35.48819 1.652400   25.10706    29.6   12.69044 1.172814          ?        ? 
1 1 1    4   41    3 o 45.89278 1.343303   29.98140    32.6   21.17079 1.232958          ?        ? 
1 1 1    4   41    4 o 43.36698 1.386868   33.33691    15.3   18.91538 1.202886          ?        ? 
1 1 1    4   41    5 o 33.77782 1.691556   26.47991   220.0   11.51763 1.142741          ?        ? 
1 1 1    4   41    6 o 9.014526 3.716474   4.960957    19.2  0.3307936 1.082597          ?        ? 
1 1 1    4   41    7 o 10.39936 4.036683   10.97805   248.6  0.8119479 1.202886          ?        ? 
1 1 1    4   41    8 o 12.49389 4.186158   21.84729   204.6   1.653968 1.232958          ?        ? 
1 1 1    4   41    9 o 82.51756 1.239073   73.45048   133.1   68.68478 2.044906          ?        ? 
1 1 1    4   41   10 o 32.78316 1.972205   20.29191    59.3   11.00640 1.293102          ?        ? 
1 1 1    4   41   11 o 39.84283 1.962400   36.46156    18.1   16.32917 1.563751          ?        ? 
1 1 1    4   41   12 o 22.94487 3.276565   12.46685   308.4   5.773852 1.503607          ?        ? 
1 1 1    4   41   13 o 14.03695 4.668837   9.819664    98.5   2.556132 1.533679          ?        ? 
1 1 1    4   42    0 o 23.80172 3.383309   7.546389     0.0   5.954284 1.563751   5.954284 1.563751 
1 1 1    4   42    1 o 29.86904 1.862580   18.86460   154.2   9.021644 1.112669          ?        ? 
1 1 1    4   42    2 o 32.04830 1.735926   18.61802   298.4   10.37489 1.112669          ?        ? 
1 1 1    4   42    3 o 44.40590 1.354421   44.88503   276.1   19.84762 1.202886          ?        ? 
1 1 1    4   42    4 o 27.09971 2.052917   23.18872   282.5   7.457891 1.112669          ?        ? 
1 1 1    4   42    5 o 13.13259 3.865549   10.76083   240.2   1.864473 1.082597          ?        ? 
1 1 1    4   42    6 o 18.51623 3.004579   16.52025    50.8   3.578585 1.112669          ?        ? 
1 1 1    4   42    7 o 32.13750 2.058614   25.21154   160.0   10.55532 1.323174          ?        ? 
1 1 1    4   42    8 o 34.25010 1.931636   32.19537     5.1   11.99879 1.323174          ?        ? 
1 1 1    4   42    9 o 24.38255 2.590029   22.46238   325.0   6.194862 1.263030          ?        ? 
1 1 1    4   42   10 o 23.49203 2.752215   13.49022   321.5   5.833996 1.293102          ?        ? 
1 1 1    4   42   11 o 8.430001 3.873961   4.784077   135.6 -0.6615872 1.503607          ?        ? 
1 1 1    4   42   12 o 17.98875 4.243058   16.35033   287.2   4.029667 1.503607          ?        ? 
1 1 1    4   43    0 o 57.06611 1.822131   33.47263    -0.0   32.86885 2.074978   32.86885 2.074978 
1 1 1    4   43    1 o 51.98549 1.243715   48.90563   215.7   27.18522 1.293102          ?        ? 
1 1 1    4   43    2 o 15.32944 3.507384   17.72207   163.1   2.556132 1.052525          ?        ? 
1 1 1    4   43    3 o 52.92587 1.250026   47.83636   241.2   28.20767 1.323174          ?        ? 
1 1 1    4   43    4 o 75.39449 1.116819   59.12395   266.0   57.19722 1.684040          ?        ? 
1 1 1    4   43    5 o 24.05258 2.375507   25.55668    52.9   5.954284 1.142741          ?        ? 
1 1 1    4   43    6 o 11.09335 3.910780   8.481839   229.2   1.232958 1.082597          ?        ? 
1 1 1    4   43    7 o 29.21865 2.264263   19.45978   128.3   8.811138 1.323174          ?        ? 
1 1 1    4   43    8 o 57.49374 1.438389   45.33310   225.1   33.50037 1.653968          ?        ? 
1 1 1    4   43    9 o 37.37073 1.850805   35.07706   300.7   14.34441 1.383319          ?        ? 
1 1 1    4   43   10 o 8.049167 3.661005   3.718481   293.6 -0.4510822 1.293102          ?        ? 
1 1 1    4   43   11 o 19.41364 4.148787   21.58575   263.0   4.631110 1.563751          ?        ? 
1 1 1    4   43   12 x        ?      ?   7.633593    78.5          ?        ?          ?        ? 
1 1 1    4   44    0 o 67.67423 1.690933   56.99627   180.0   46.22089 2.285483   46.22089 2.285483 
1 1 1    4   44    1 o 9.133615 3.667623   13.74551    54.0  0.5112265 1.022453          ?        ? 
1 1 1    4   44    2 o 24.42351 2.339429   26.35653   232.1   6.134717 1.142741          ?        ? 
1 1 1    4   44    3 f 11.62379 4.025602   20.74436   319.2   1.383319 1.142741          ?        ? 
1 1 1    4   44    4 o 28.20658 2.025665   13.25853    46.1   8.149551 1.142741          ?        ? 
1 1 1    4   44    5 f 18.61197 3.069910   11.35038   271.4   3.668802 1.142741          ?        ? 
1 1 1    4   44    6 f 13.00828 3.939186   15.79191   245.4   1.894545 1.112669          ?        ? 
1 1 1    4   44    7 o 13.89407 4.254465   11.94281   254.6   2.225339 1.293102          ?        ? 
1 1 1    4   44    8 o 16.41527 3.975276   8.616693   328.1   3.157575 1.293102          ?        ? 
1 1 1    4   44    9 o 42.56586 1.660240   36.43766   353.0   18.58459 1.413391          ?        ? 
1 1 1    4   44   10 o 23.25195 2.586635   16.76276   315.2   5.833996 1.202886          ?        ? 
1 1 1    4   44   11 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1    4   45    0 o 31.56773 2.606523   15.53644     0.0   10.37489 1.623896   10.37489 1.623896 
1 1 1    4   45    1 o 52.68494 1.312822   35.23418   300.5   28.05731 1.383319          ?        ? 
1 1 1    4   45    2 o 46.86484 1.379608   30.93030   245.8   22.22332 1.293102          ?        ? 
1 1 1    4   45    3 o 35.47739 1.695285   22.22656   307.1   12.81073 1.202886          ?        ? 
1 1 1    4   45    4 o 38.36551 1.646049   27.23983     3.3   14.97593 1.263030          ?        ? 
1 1 1    4   45    5 o 34.16452 1.804442   28.92879   316.5   11.93864 1.232958          ?        ? 
1 1 1    4   45    6 o 27.01847 2.170393   22.12297    52.8   7.578181 1.172814          ?        ? 
1 1 1    4   45    7 o 48.27736 1.526114   36.16260   347.3   23.78707 1.473535          ?        ? 
1 1 1    4   45    8 o 33.07457 2.091212   30.62952     8.1   11.42741 1.383319          ?        ? 
1 1 1    4   45    9 o 10.23892 4.119132   5.185297   255.4  0.9623086 1.293102          ?        ? 
1 1 1    4   46    0 o 24.93421 3.221828   19.10323   180.0   6.736160 1.563751   6.736160 1.563751 
1 1 1    4   46    1 o 20.80732 2.818271   14.00208   107.4   4.570966 1.172814          ?        ? 
1 1 1    4   46    2 o 27.31432 2.091836   31.08683    37.1   7.698469 1.142741          ?        ? 
1 1 1    4   46    3 o 20.00568 2.931201   11.20451    37.6   4.270245 1.172814          ?        ? 
1 1 1    4   46    4 o 13.26914 3.923046   10.96937   357.3   2.044906 1.112669          ?        ? 
1 1 1    4   46    5 o 45.75352 1.445981   34.70337    86.6   21.32115 1.323174          ?        ? 
1 1 1    4   46    6 o 6.886374 3.233262   6.733813   303.5 -0.9322364 1.142741          ?        ? 
1 1 1    4   46    7 o 17.99823 3.636040   10.33525   244.2   3.819162 1.263030          ?        ? 
1 1 1    4   46    8 o 21.28780 3.037191   23.70955   152.2   5.052120 1.293102          ?        ? 
1 1 1    4   47    0 o 28.52803 3.011161   22.56387     0.0   8.720922 1.684040   8.720922 1.684040 
1 1 1    4   47    1 o 7.519311 3.393742   7.292775    10.5 -0.3307936 1.082597          ?        ? 
1 1 1    4   47    2 o 15.78595 3.683295   16.23843   248.2   2.886926 1.142741          ?        ? 
1 1 1    4   47    3 o 12.45130 4.082784   8.867199    63.3   1.804329 1.172814          ?        ? 
1 1 1    4   47    4 o 33.53332 1.838407   25.79441    79.3   11.63792 1.232958          ?        ? 
1 1 1    4   47    5 o 21.68375 2.635019   21.68766   307.3   5.082192 1.142741          ?        ? 
1 1 1    4   47    6 o 38.03319 1.699966   29.09094   196.1   14.97593 1.293102          ?        ? 
1 1 1    4   48    0 o 41.40599 2.154862   22.27682    -0.0   17.74257 1.774257   17.74257 1.774257 
1 1 1    4   48    1 o 11.88189 4.030103   18.94515   216.8   1.684040 1.142741          ?        ? 
1 1 1    4   48    2 o 10.02375 3.884114   7.971743   295.2  0.9923807 1.112669          ?        ? 
1 1 1    4   48    3 o 14.17405 3.907422   8.826687   347.7   2.465916 1.142741          ?        ? 
1 1 1    4   48    4 o 10.19068 3.899468   8.164670   129.4   1.082597 1.112669          ?        ? 
1 1 1    5    0    1 o 224.5513 2.022576   738.8891   270.0   504.4001 9.081788   504.4001 9.081788 
1 1 1    5    0    2 o 242.2564 2.129260   297.6360   270.0   587.0684 10.31474   587.0684 10.31474 
1 1 1    5    0    3 o 740.4423 11.56906   920.4562   270.0   5501.157 171.2308   5501.157 171.2308 
1 1 1    5    0    4 o 51.06871 0.8543767   409.2027   270.0   26.10262 0.8720922   26.10262 0.8720922 
1 1 1    5    0    5 o 43.48812 1.038569   117.7018    90.0   18.94545 0.9021643   18.94545 0.9021643 
1 1 1    5    0    6 o 23.19541 1.041690   46.73863    90.0   5.412986 0.4811543   5.412986 0.4811543 
1 1 1    5    0    7 o 88.42962 1.241799   16.65956   270.0   78.24773 2.195267   78.24773 2.195267 
1 1 1    5    0    8 o 198.0997 2.254932   332.8904    90.0   392.6219 8.931427   392.6219 8.931427 
1 1 1    5    0    9 f 298.3293 3.075189   141.5125   270.0   890.4663 18.34401   890.4663 18.34401 
1 1 1    5    0   10 o 34.32888 1.451002   59.18719    90.0   11.84843 0.9923807   11.84843 0.9923807 
1 1 1    5    0   11 o 336.7908 4.104255   346.3795   270.0   1135.554 27.63630   1135.554 27.63630 
1 1 1    5    0   12 o 85.95383 1.400287   63.69105    90.0   73.94740 2.405771   73.94740 2.405771 
1 1 1    5    0   13 o 16.34153 3.324951   43.17169    90.0   2.977142 0.9623086   2.977142 0.9623086 
1 1 1    5    0   14 o 78.07153 1.310462   59.40768    90.0   61.01638 2.044906   61.01638 2.044906 
1 1 1    5    0   15 o 15.01356 4.387395   4.136422   270.0   2.766637 1.142741   2.766637 1.142741 
1 1 1    5    0   16 o 115.3604 1.499478   96.58409    90.0   133.2196 3.458297   133.2196 3.458297 
1 1 1    5    0   17 o 6.224192 4.068089   19.43344    90.0      -0.06 1.202886      -0.06 1.202886 
1 1 1    5    0   18 o 99.87469 1.792828   102.8998   270.0   99.95981 3.578585   99.95981 3.578585 
1 1 1    5    0   19 o 38.20694 3.314031   45.13130   270.0   15.00600 2.495988   15.00600 2.495988 
1 1 1    5    0   20 o 8.284482 5.342669   9.025652   270.0  0.1804329 1.984761  0.1804329 1.984761 
1 1 1    5    0   21 o 6.604957 4.296581   16.46888    90.0       0.03 1.323174       0.03 1.323174 
1 1 1    5    0   22 o 53.60841 2.650298   48.80891    90.0   29.32034 2.826782   29.32034 2.826782 
1 1 1    5    0   23 o 45.33719 3.045987   43.87649   270.0   21.41137 2.736565   21.41137 2.736565 
1 1 1    5    0   24 o 31.52151 4.016724   32.71412   270.0   11.06655 2.465916   11.06655 2.465916 
1 1 1    5    0   25 x        ?      ?   18.08802    90.0          ?        ?          ?        ? 
1 1 1    5    1    0 o 34.75325 0.6061251   107.3594     0.0   12.08900 0.4210100   12.08900 0.4210100 
1 1 1    5    1    1 o 384.0828 2.478068   832.4453   246.5   1475.580 19.03567          ?        ? 
1 1 1    5    1    2 o 591.8467 4.809232   1054.931   257.3   3505.901 56.92657          ?        ? 
1 1 1    5    1    3 o 164.6194 1.159998   286.6987   321.5   271.0102 3.819162          ?        ? 
1 1 1    5    1    4 o 191.3397 1.445929   370.0672    95.5   366.1584 5.533275          ?        ? 
1 1 1    5    1    5 o 308.0764 2.396390   199.0849    56.6   949.6182 14.76542          ?        ? 
1 1 1    5    1    6 o 245.3490 1.930460   206.0988    64.1   602.1346 9.472726          ?        ? 
1 1 1    5    1    7 o 161.2572 1.296075   304.6083    25.7   260.0639 4.180028          ?        ? 
1 1 1    5    1    8 o 117.5483 1.074478   201.1720   233.2   138.1815 2.526060          ?        ? 
1 1 1    5    1    9 o 258.7895 1.934782   308.7568    34.3   669.8269 10.01402          ?        ? 
1 1 1    5    1   10 o 112.3811 1.083743   100.9572   251.1   126.3030 2.435844          ?        ? 
1 1 1    5    1   11 o 229.9182 1.772272   195.0924    17.6   528.7585 8.149551          ?        ? 
1 1 1    5    1   12 o 242.2000 1.837605   260.6161   305.1   586.8278 8.901355          ?        ? 
1 1 1    5    1   13 o 29.57699 1.372601   53.98497   184.3   8.750995 0.8119479          ?        ? 
1 1 1    5    1   14 o 51.72773 0.9883025   52.80915   283.4   26.76421 1.022453          ?        ? 
1 1 1    5    1   15 o 129.2290 1.128616   146.1252   151.0   167.0808 2.916998          ?        ? 
1 1 1    5    1   16 f 84.43900 0.9615793   42.81157    29.4   71.33112 1.623896          ?        ? 
1 1 1    5    1   17 o 44.90239 1.205501   39.91271   146.7   20.17841 1.082597          ?        ? 
1 1 1    5    1   18 o 19.03985 2.290176   12.49050    45.5   3.638730 0.8720922          ?        ? 
1 1 1    5    1   19 o 46.61376 1.387039   59.78448   317.3   21.77223 1.293102          ?        ? 
1 1 1    5    1   20 o 16.46165 2.937231   28.86179   103.0   2.826782 0.9322364          ?        ? 
1 1 1    5    1   21 o 18.16249 3.843394   18.13114   223.0   3.548513 1.353247          ?        ? 
1 1 1    5    1   22 o 23.02398 3.200001   27.91887   194.7   5.503202 1.473535          ?        ? 
1 1 1    5    1   23 o 33.25726 2.215358   35.67308   139.5   11.39734 1.473535          ?        ? 
1 1 1    5    1   24 o 12.94560 5.307114   6.621797   115.9   1.563751 2.195267          ?        ? 
1 1 1    5    1   25 x        ?      ?   46.66938   325.5          ?        ?          ?        ? 
1 1 1    5    2    0 o 274.0344 2.480548   270.2161   180.0   751.2323 13.59261   751.2323 13.59261 
1 1 1    5    2    1 o 391.1397 2.740893   1106.090    92.1   1530.371 21.44144          ?        ? 
1 1 1    5    2    2 o 230.6332 1.727661   558.0339   322.9   531.9763 7.969118          ?        ? 
1 1 1    5    2    3 o 639.3676 4.661089   739.8489    89.6   4091.616 59.60299          ?        ? 
1 1 1    5    2    4 o 419.3163 2.857926   685.0493   162.2   1759.251 23.96750          ?        ? 
1 1 1    5    2    5 o 123.6291 1.033791   184.4801     3.3   152.8567 2.556132          ?        ? 
1 1 1    5    2    6 o 448.0249 3.312450   577.4299    45.6   2008.940 29.68121          ?        ? 
1 1 1    5    2    7 o 50.58703 0.8025258   100.4874   316.6   25.59139 0.8119479          ?        ? 
1 1 1    5    2    8 o 214.9781 1.825495   312.8766    29.0   462.2089 7.848830          ?        ? 
1 1 1    5    2    9 o 272.1838 2.077112   306.2500   222.0   740.9777 11.30713          ?        ? 
1 1 1    5    2   10 o 220.0876 1.707964   307.4445   257.5   484.4622 7.518036          ?        ? 
1 1 1    5    2   11 o 348.8110 2.495875   330.1801   345.2   1217.320 17.41177          ?        ? 
1 1 1    5    2   12 o 139.0424 1.286868   163.9933   151.2   193.3639 3.578585          ?        ? 
1 1 1    5    2   13 o 95.24273 0.9788007   132.4466   140.3   90.72766 1.864473          ?        ? 
1 1 1    5    2   14 f 139.2352 1.198694   145.7290    50.7   193.9353 3.338008          ?        ? 
1 1 1    5    2   15 o 59.70963 0.9820977   75.03979   266.8   35.66556 1.172814          ?        ? 
1 1 1    5    2   16 o 85.12862 1.006778   117.6890   318.7   72.50394 1.714112          ?        ? 
1 1 1    5    2   17 o 188.4114 1.635992   194.5640   304.7   355.5129 6.164790          ?        ? 
1 1 1    5    2   18 o 138.5670 1.551710   142.6225    37.5   192.3414 4.300317          ?        ? 
1 1 1    5    2   19 o 13.34166 3.625174   18.68986   118.9   1.864473 0.9923807          ?        ? 
1 1 1    5    2   20 o 22.24119 2.433766   20.28257   126.1   4.991976 1.082597          ?        ? 
1 1 1    5    2   21 o 92.77647 1.717918   90.75247   183.9   86.75814 3.187647          ?        ? 
1 1 1    5    2   22 f 75.62077 1.471381   68.72868   324.5   57.64830 2.225339          ?        ? 
1 1 1    5    2   23 o 27.29848 3.029414   32.57120   135.4   7.878902 1.653968          ?        ? 
1 1 1    5    2   24 o 15.17219 5.754735   16.93027   327.2   2.856854 2.405771          ?        ? 
1 1 1    5    2   25 o 14.25825 5.788558   26.46991   103.0   2.916998 2.586205          ?        ? 
1 1 1    5    3    0 o 457.8752 4.493320   496.1327     0.0   2097.953 41.13869   2097.953 41.13869 
1 1 1    5    3    1 o 190.9178 1.646016   196.5868   242.3   364.5345 6.285078          ?        ? 
1 1 1    5    3    2 o 321.9704 2.316329   123.6749   159.3   1036.857 14.91578          ?        ? 
1 1 1    5    3    3 o 113.3417 0.9020975   228.7368   203.7   128.4682 2.044906          ?        ? 
1 1 1    5    3    4 o 315.1334 2.042132   420.2445   239.3   993.4032 12.87088          ?        ? 
1 1 1    5    3    5 o 204.7046 1.402943   249.8774   267.3   419.1155 5.743780          ?        ? 
1 1 1    5    3    6 o 292.8531 1.935646   311.8083   135.7   857.8680 11.33720          ?        ? 
1 1 1    5    3    7 o 379.7466 2.617231   464.2471   131.3   1442.591 19.87769          ?        ? 
1 1 1    5    3    8 o 404.0663 2.776007   526.2068   114.9   1633.128 22.43382          ?        ? 
1 1 1    5    3    9 o 236.5763 1.805018   275.1569    94.2   559.7629 8.540489          ?        ? 
1 1 1    5    3   10 o 334.4699 2.243251   350.0140    21.4   1119.015 15.00600          ?        ? 
1 1 1    5    3   11 o 57.43410 0.9162893   125.2260   288.4   32.98914 1.052525          ?        ? 
1 1 1    5    3   12 o 172.3323 1.413458   200.5287    51.4   297.0526 4.871688          ?        ? 
1 1 1    5    3   13 o 123.0583 1.197428   133.5728   253.1   151.4734 2.947070          ?        ? 
1 1 1    5    3   14 o 111.5080 1.092228   204.1504   168.6   124.3784 2.435844          ?        ? 
1 1 1    5    3   15 o 21.29158 2.047974   26.76211    99.5   4.540894 0.8720922          ?        ? 
1 1 1    5    3   16 o 108.7376 1.078572   129.9663   101.4   118.3038 2.345627          ?        ? 
1 1 1    5    3   17 o 35.34903 1.446225   39.66020    77.5   12.51001 1.022453          ?        ? 
1 1 1    5    3   18 o 91.27741 1.103687   103.3161   103.9   83.39005 2.014834          ?        ? 
1 1 1    5    3   19 o 62.98816 1.074207   53.45115   255.2   39.72530 1.353247          ?        ? 
1 1 1    5    3   20 o 21.19481 2.624862   3.087327     3.8   4.540894 1.112669          ?        ? 
1 1 1    5    3   21 f 40.29831 1.641724   38.31475   271.6   16.35925 1.323174          ?        ? 
1 1 1    5    3   22 o 17.37686 3.409648   12.56850   336.1   3.247792 1.142741          ?        ? 
1 1 1    5    3   23 o 22.74399 3.041065   19.92665   214.6   5.473131 1.383319          ?        ? 
1 1 1    5    3   24 o 65.28265 1.474065   61.50332   346.8   43.42418 1.924617          ?        ? 
1 1 1    5    3   25 o 10.81245 4.324442   19.96057   331.4   1.202886 1.413391          ?        ? 
1 1 1    5    4    0 o 155.4588 2.380577   23.69110   180.0   241.8703 7.397748   241.8703 7.397748 
1 1 1    5    4    1 o 535.2737 5.191113   388.7102    72.7   2868.071 55.57333          ?        ? 
1 1 1    5    4    2 f 153.0979 1.581216   354.4161   277.8   234.4124 4.841615          ?        ? 
1 1 1    5    4    3 o 583.3608 3.894589   697.9974   248.2   3405.731 45.43901          ?        ? 
1 1 1    5    4    4 o 372.9796 2.592151   520.6143   263.4   1391.919 19.33639          ?        ? 
1 1 1    5    4    5 o 64.93031 0.6715602   258.9557   146.2   42.16114 0.8720922          ?        ? 
1 1 1    5    4    6 o 393.0141 2.689562   480.7681   253.3   1545.407 21.14072          ?        ? 
1 1 1    5    4    7 o 270.6237 2.105755   305.0150    64.9   732.5273 11.39734          ?        ? 
1 1 1    5    4    8 o 104.5933 1.135684   216.8086   230.4   109.4025 2.375700          ?        ? 
1 1 1    5    4    9 o 332.4300 2.587202   329.7471   146.0   1105.422 17.20127          ?        ? 
1 1 1    5    4   10 f 169.1979 1.510735   249.8897   259.1   286.3169 5.112265          ?        ? 
1 1 1    5    4   11 o 95.32574 0.9937218   138.3472   113.3   90.87802 1.894545          ?        ? 
1 1 1    5    4   12 o 276.6801 2.054227   325.1025   265.4   765.9074 11.36727          ?        ? 
1 1 1    5    4   13 o 84.37877 0.9979051   98.50325    46.2   71.21084 1.684040          ?        ? 
1 1 1    5    4   14 o 34.28293 1.271904   34.46450   238.6   11.75821 0.8720922          ?        ? 
1 1 1    5    4   15 o 116.6540 1.224499   122.7365   290.2   136.1667 2.856854          ?        ? 
1 1 1    5    4   16 o 88.00858 1.059256   101.4848   282.5   77.49592 1.864473          ?        ? 
1 1 1    5    4   17 o 84.94478 1.079761   87.78149    74.3   72.20322 1.834401          ?        ? 
1 1 1    5    4   18 o 36.95718 1.546034   44.75713   192.8   13.68283 1.142741          ?        ? 
1 1 1    5    4   19 o 39.28718 1.722250   45.69426   276.5   15.48715 1.353247          ?        ? 
1 1 1    5    4   20 o 52.85360 1.166390   63.86304    16.2   27.99717 1.232958          ?        ? 
1 1 1    5    4   21 o 28.14852 2.190094   35.43470   268.2   8.029263 1.232958          ?        ? 
1 1 1    5    4   22 o 42.52772 1.803152   37.28378    84.0   18.31394 1.533679          ?        ? 
1 1 1    5    4   23 o 8.802998 3.833006   13.74780   246.8   0.000000 1.263030          ?        ? 
1 1 1    5    4   24 o 21.57623 3.345031   16.42341   353.0   5.112265 1.443463          ?        ? 
1 1 1    5    4   25 o 39.43409 2.630944   38.99494    84.3   16.96069 2.074978          ?        ? 
1 1 1    5    5    0 o 542.2151 6.646545   815.7707     0.0   2943.732 72.05286   2943.732 72.05286 
1 1 1    5    5    1 o 323.6607 2.606198   437.4504    37.4   1047.834 16.87047          ?        ? 
1 1 1    5    5    2 o 525.9783 3.573359   558.8519   292.3   2768.051 37.59018          ?        ? 
1 1 1    5    5    3 o 175.6945 1.360735   127.8547   249.1   308.7206 4.781471          ?        ? 
1 1 1    5    5    4 o 140.0717 1.062721   342.0146     2.7   196.2207 2.977142          ?        ? 
1 1 1    5    5    5 o 140.1367 1.040769   148.7151   260.2   196.4012 2.916998          ?        ? 
1 1 1    5    5    6 o 185.3124 1.403705   302.0381   313.7   343.4539 5.202481          ?        ? 
1 1 1    5    5    7 o 215.7805 1.658438   325.8576    13.4   465.6672 7.157170          ?        ? 
1 1 1    5    5    8 o 305.4429 2.372747   339.0517    53.9   933.1387 14.49477          ?        ? 
1 1 1    5    5    9 o 106.6428 1.085659   131.7780   263.8   113.7329 2.315555          ?        ? 
1 1 1    5    5   10 o 244.0162 1.990299   331.6405   352.2   595.5788 9.713303          ?        ? 
1 1 1    5    5   11 o 160.7910 1.477508   185.5222   183.5   258.5904 4.751399          ?        ? 
1 1 1    5    5   12 f 187.8779 1.456566   209.0705   191.4   353.0771 5.473131          ?        ? 
1 1 1    5    5   13 o 226.2811 1.701085   254.7047   199.6   512.3090 7.698469          ?        ? 
1 1 1    5    5   14 o 100.1466 0.9909285   109.7996   117.9   100.3207 1.984761          ?        ? 
1 1 1    5    5   15 o 107.9634 1.086307   136.9798   264.9   116.6198 2.345627          ?        ? 
1 1 1    5    5   16 o 53.09857 0.9911049   51.64613   281.9   28.20767 1.052525          ?        ? 
1 1 1    5    5   17 o 150.6916 1.347036   153.0477    19.8   227.3154 4.059740          ?        ? 
1 1 1    5    5   18 o 119.6198 1.256989   131.3756   196.6   143.2637 3.007215          ?        ? 
1 1 1    5    5   19 o 14.90162 3.736823   17.84540   210.8   2.345627 1.112669          ?        ? 
1 1 1    5    5   20 o 42.36750 1.419586   37.57503    71.2   18.01322 1.202886          ?        ? 
1 1 1    5    5   21 o 79.92362 1.279288   71.74011   312.1   64.17396 2.044906          ?        ? 
1 1 1    5    5   22 o 24.48080 2.886733   20.19629   286.1   6.194862 1.413391          ?        ? 
1 1 1    5    5   23 o 27.01607 2.337553   23.85282     2.7   7.548109 1.263030          ?        ? 
1 1 1    5    5   24 o 25.26640 2.796977   17.74939   274.1   6.826377 1.413391          ?        ? 
1 1 1    5    6    0 o 111.3086 1.933012   471.3607    -0.0   124.0175 4.300317   124.0175 4.300317 
1 1 1    5    6    1 o 151.5093 1.429083   548.2707    38.4   229.5708 4.330389          ?        ? 
1 1 1    5    6    2 o 64.62900 0.7212215   37.70810    22.2   41.77021 0.9322364          ?        ? 
1 1 1    5    6    3 o 135.0891 1.113049   190.3174   294.5   182.5079 3.007215          ?        ? 
1 1 1    5    6    4 o 32.67292 0.6442797   153.4611   145.7   10.67561 0.4210100          ?        ? 
1 1 1    5    6    5 o 146.0608 1.194150   130.6872   149.4   213.3619 3.488369          ?        ? 
1 1 1    5    6    6 o 165.5977 1.334742   207.1261   301.8   274.2580 4.420605          ?        ? 
1 1 1    5    6    7 o 588.4202 3.914765   614.0114   254.4   3464.431 46.07053          ?        ? 
1 1 1    5    6    8 o 521.1753 3.508198   619.9788   194.1   2717.469 36.56773          ?        ? 
1 1 1    5    6    9 o 343.0414 2.643049   416.4882   276.9   1177.144 18.13350          ?        ? 
1 1 1    5    6   10 o 160.5072 1.433281   189.8419    36.9   257.6581 4.601038          ?        ? 
1 1 1    5    6   11 o 85.05594 1.096028   140.9895   293.4   72.35358 1.864473          ?        ? 
1 1 1    5    6   12 o 88.31480 1.055584   133.8331   192.4   78.00714 1.864473          ?        ? 
1 1 1    5    6   13 o 91.39172 0.9871402   95.28696    85.7   83.54041 1.804329          ?        ? 
1 1 1    5    6   14 o 31.49367 1.336809   62.60593    19.5   9.923808 0.8420200          ?        ? 
1 1 1    5    6   15 o 55.45462 0.9489968   95.08820    88.5   30.76381 1.052525          ?        ? 
1 1 1    5    6   16 o 62.17307 0.9673688   81.25245    94.3   38.67278 1.202886          ?        ? 
1 1 1    5    6   17 o 61.75489 1.046964   80.42170   138.9   38.16155 1.293102          ?        ? 
1 1 1    5    6   18 o 51.93820 1.157997   63.62618   184.0   27.00479 1.202886          ?        ? 
1 1 1    5    6   19 o 40.24523 1.457084   60.85359   236.9   16.23896 1.172814          ?        ? 
1 1 1    5    6   20 o 91.96216 1.275322   104.4772   284.6   84.83352 2.345627          ?        ? 
1 1 1    5    6   21 o 36.85658 1.591051   31.69118   331.4   13.68283 1.172814          ?        ? 
1 1 1    5    6   22 o 9.597527 3.930514   13.75906   349.2  0.4510822 1.202886          ?        ? 
1 1 1    5    6   23 o 29.10944 2.169451   25.81859   297.1   8.720922 1.263030          ?        ? 
1 1 1    5    6   24 o 45.37756 1.723045   41.26445   167.7   21.14072 1.563751          ?        ? 
1 1 1    5    7    0 o 183.0037 2.227348   306.6323   180.0   335.0939 8.149551   335.0939 8.149551 
1 1 1    5    7    1 o 84.09913 0.8939494   335.1033    63.4   70.72968 1.503607          ?        ? 
1 1 1    5    7    2 o 241.1154 1.864578   228.2479   116.6   581.5051 8.991571          ?        ? 
1 1 1    5    7    3 o 113.3916 1.021044   180.3557   238.7   128.5885 2.315555          ?        ? 
1 1 1    5    7    4 o 117.0449 1.053406   115.2437   146.7   137.0087 2.465916          ?        ? 
1 1 1    5    7    5 o 162.1101 1.307806   298.8508   285.2   262.8305 4.240172          ?        ? 
1 1 1    5    7    6 o 243.1848 1.947639   312.9208   212.2   591.5191 9.472726          ?        ? 
1 1 1    5    7    7 o 100.5183 0.9423885   175.2066   135.6   101.0424 1.894545          ?        ? 
1 1 1    5    7    8 o 382.1953 2.675211   462.7747    73.1   1461.145 20.44906          ?        ? 
1 1 1    5    7    9 o 193.1798 1.533342   126.6485   121.0   373.2254 5.924213          ?        ? 
1 1 1    5    7   10 o 102.4124 1.130506   104.6177    43.7   104.8916 2.315555          ?        ? 
1 1 1    5    7   11 o 314.5339 2.457141   415.9952    95.3   989.9149 15.45708          ?        ? 
1 1 1    5    7   12 o 80.02649 1.070965   83.60193   106.8   64.05367 1.714112          ?        ? 
1 1 1    5    7   13 o 236.6850 1.975714   283.8752   313.9   560.6651 9.352437          ?        ? 
1 1 1    5    7   14 o 71.44731 0.9680691   70.73641   303.2   51.06250 1.383319          ?        ? 
1 1 1    5    7   15 o 81.24769 0.9993491   79.14415   146.7   66.03843 1.623896          ?        ? 
1 1 1    5    7   16 o 124.1250 1.150797   135.8202   129.8   154.1799 2.856854          ?        ? 
1 1 1    5    7   17 o 128.6056 1.215928   108.4731   267.2   165.5471 3.127503          ?        ? 
1 1 1    5    7   18 o 34.12816 1.453903   33.54399    46.0   11.66799 0.9923807          ?        ? 
1 1 1    5    7   19 o 25.13027 1.974473   29.91747   256.8   6.345222 0.9923807          ?        ? 
1 1 1    5    7   20 o 45.71054 1.480235   52.99113   253.7   20.99036 1.353247          ?        ? 
1 1 1    5    7   21 o 27.92766 2.476611   18.78360    68.5   7.939046 1.383319          ?        ? 
1 1 1    5    7   22 o 10.43776 3.925949   15.06177   328.4  0.9322364 1.112669          ?        ? 
1 1 1    5    7   23 o 12.85553 4.336611   3.393048   323.6   1.804329 1.323174          ?        ? 
1 1 1    5    7   24 o 17.95109 3.726275   19.81425    17.1   3.728946 1.293102          ?        ? 
1 1 1    5    8    0 o 8.953198 2.701318   341.3069   180.0  0.9923807 0.4210100  0.9923807 0.4210100 
1 1 1    5    8    1 o 191.9229 1.606059   432.7112   314.7   368.4138 6.164790          ?        ? 
1 1 1    5    8    2 o 19.07483 0.8670942   26.51583    68.1   3.638730 0.3307936          ?        ? 
1 1 1    5    8    3 o 311.0653 2.276689   251.8984   323.1   968.0825 14.16398          ?        ? 
1 1 1    5    8    4 o 165.8493 1.323651   259.3641   225.8   275.1000 4.390533          ?        ? 
1 1 1    5    8    5 o 89.98879 0.8855680   199.0411   194.5   80.98428 1.593824          ?        ? 
1 1 1    5    8    6 o 395.9082 2.711678   503.3066    59.4   1567.992 21.47151          ?        ? 
1 1 1    5    8    7 o 375.7462 2.857183   383.4796    70.7   1412.248 21.47151          ?        ? 
1 1 1    5    8    8 o 201.9151 1.720195   252.7339   309.8   407.7482 6.946666          ?        ? 
1 1 1    5    8    9 o 405.5739 2.780517   344.1415   354.8   1645.548 22.55411          ?        ? 
1 1 1    5    8   10 o 127.6973 1.142153   212.7817   170.3   163.0812 2.916998          ?        ? 
1 1 1    5    8   11 o 145.8384 1.381552   138.8094   128.3   212.7304 4.029667          ?        ? 
1 1 1    5    8   12 o 64.90200 1.088865   110.1754   187.0   42.13108 1.413391          ?        ? 
1 1 1    5    8   13 o 271.2024 2.228778   286.4066   188.7   736.3766 12.08900          ?        ? 
1 1 1    5    8   14 o 20.86588 2.161818   18.11465   180.7   4.360461 0.9021643          ?        ? 
1 1 1    5    8   15 o 48.14062 1.061944   75.47515   352.2   23.18562 1.022453          ?        ? 
1 1 1    5    8   16 o 84.03673 1.073536   97.09025   165.8   70.66954 1.804329          ?        ? 
1 1 1    5    8   17 o 107.6841 1.089125   104.3385   169.0   116.0484 2.345627          ?        ? 
1 1 1    5    8   18 o 62.46844 1.083144   62.60141   118.5   39.06371 1.353247          ?        ? 
1 1 1    5    8   19 f 55.50130 1.164930   64.63095   143.6   30.85402 1.293102          ?        ? 
1 1 1    5    8   20 o 42.39282 1.347801   29.32145   170.9   18.04329 1.142741          ?        ? 
1 1 1    5    8   21 o 16.09830 4.170428   21.36045   250.8   2.826782 1.353247          ?        ? 
1 1 1    5    8   22 o 9.552823 3.924420   7.411357   324.3  0.4510822 1.202886          ?        ? 
1 1 1    5    8   23 o 6.937605 3.358939   7.464056   359.1  -2.105050 1.443463          ?        ? 
1 1 1    5    8   24 o 26.42855 2.901558   23.14722   338.1   7.548109 1.533679          ?        ? 
1 1 1    5    9    0 o 329.6275 3.033997   317.9447     0.0   1087.258 19.99798   1087.258 19.99798 
1 1 1    5    9    1 o 284.9580 2.015658   408.4212   286.8   812.3088 11.48756          ?        ? 
1 1 1    5    9    2 f 193.9211 1.589510   325.5671   215.7   376.1424 6.164790          ?        ? 
1 1 1    5    9    3 o 278.7110 2.087811   325.0576   294.5   777.0943 11.63792          ?        ? 
1 1 1    5    9    4 o 334.3459 2.387992   596.0197   300.2   1118.353 15.96831          ?        ? 
1 1 1    5    9    5 o 267.5398 2.000765   413.5401   184.6   715.9576 10.70568          ?        ? 
1 1 1    5    9    6 o 219.4771 1.671610   274.4616    78.7   481.7558 7.337603          ?        ? 
1 1 1    5    9    7 o 247.1369 2.038176   269.8863   179.6   610.8555 10.07417          ?        ? 
1 1 1    5    9    8 o 131.7894 1.266418   196.6082   178.6   173.6967 3.338008          ?        ? 
1 1 1    5    9    9 o 106.9234 1.124997   121.3658    54.4   114.3343 2.405771          ?        ? 
1 1 1    5    9   10 o 111.8426 1.102404   168.8825   123.2   125.1001 2.465916          ?        ? 
1 1 1    5    9   11 o 115.6599 1.144022   159.6015    67.0   133.7910 2.646349          ?        ? 
1 1 1    5    9   12 o 249.1390 2.051973   228.4164    16.3   621.1702 10.22453          ?        ? 
1 1 1    5    9   13 o 180.1752 1.593943   211.1964   352.3   324.8393 5.743780          ?        ? 
1 1 1    5    9   14 o 39.76183 1.247907   77.90488   187.2   15.81795 0.9923807          ?        ? 
1 1 1    5    9   15 o 137.4559 1.225150   161.9511   328.7   189.0636 3.368080          ?        ? 
1 1 1    5    9   16 o 107.6317 1.089654   135.2481    32.9   115.9281 2.345627          ?        ? 
1 1 1    5    9   17 o 41.52484 1.267344   36.27396   122.4   17.26141 1.052525          ?        ? 
1 1 1    5    9   18 o 11.60103 3.624624   11.16996   221.6   1.353247 0.9322364          ?        ? 
1 1 1    5    9   19 o 136.2267 1.291392   135.9577   206.0   185.9662 3.518441          ?        ? 
1 1 1    5    9   20 o 57.90671 1.090573   59.03825   223.3   33.62066 1.263030          ?        ? 
1 1 1    5    9   21 o 6.491323 2.990382   14.99180   226.9 -0.6615872 0.9021643          ?        ? 
1 1 1    5    9   22 o 50.19395 1.467841   44.97070   342.8   25.47111 1.473535          ?        ? 
1 1 1    5    9   23 o 14.12188 4.415923   23.95966    18.1   2.285483 1.383319          ?        ? 
1 1 1    5    9   24 o 7.036460 3.404531   4.182784    51.8  -1.894545 1.473535          ?        ? 
1 1 1    5   10    0 o 186.4100 1.960556   123.0678   360.0   347.6641 7.307531   347.6641 7.307531 
1 1 1    5   10    1 o 276.3086 1.991687   570.6949   327.9   763.7422 11.00640          ?        ? 
1 1 1    5   10    2 o 220.0997 1.639556   249.4359   207.8   484.5525 7.217315          ?        ? 
1 1 1    5   10    3 o 136.0085 1.193966   275.0756   163.2   185.0038 3.247792          ?        ? 
1 1 1    5   10    4 o 245.5134 1.880172   385.0775    68.7   602.9164 9.232149          ?        ? 
1 1 1    5   10    5 o 177.3563 1.398852   224.4280   172.6   314.5847 4.961904          ?        ? 
1 1 1    5   10    6 o 63.12263 0.8098941   198.1130   330.3   39.84559 1.022453          ?        ? 
1 1 1    5   10    7 o 57.72234 0.9898607   208.8079   185.8   33.31994 1.142741          ?        ? 
1 1 1    5   10    8 o 224.9653 1.878128   218.6592   289.1   506.1743 8.450273          ?        ? 
1 1 1    5   10    9 o 347.3460 2.662240   323.8924   241.0   1207.006 18.49437          ?        ? 
1 1 1    5   10   10 o 187.3264 1.669547   137.8331    12.8   351.0020 6.255006          ?        ? 
1 1 1    5   10   11 o 418.7585 3.536772   476.0535   156.7   1756.183 29.62106          ?        ? 
1 1 1    5   10   12 o 193.6991 1.560282   257.9620   183.4   375.3605 6.044501          ?        ? 
1 1 1    5   10   13 o 146.1791 1.357760   153.7277   251.0   213.7829 3.969523          ?        ? 
1 1 1    5   10   14 o 39.60889 1.290686   63.52182    92.3   15.69766 1.022453          ?        ? 
1 1 1    5   10   15 o 32.00208 1.644463   36.69472   104.0   10.25460 1.052525          ?        ? 
1 1 1    5   10   16 o 47.53586 1.170347   46.62079    33.4   22.61425 1.112669          ?        ? 
1 1 1    5   10   17 o 37.32838 1.450099   42.13376   285.5   13.95348 1.082597          ?        ? 
1 1 1    5   10   18 o 11.22519 3.915277   17.21189    37.7   1.142741 1.082597          ?        ? 
1 1 1    5   10   19 o 34.99723 1.718545   42.17505    55.8   12.29951 1.202886          ?        ? 
1 1 1    5   10   20 o 19.99327 2.632198   23.93572   306.9   4.059740 1.052525          ?        ? 
1 1 1    5   10   21 o 11.67691 3.867744   11.16233   231.6   1.383319 1.052525          ?        ? 
1 1 1    5   10   22 o 37.03449 1.583407   39.80654   344.6   13.89333 1.172814          ?        ? 
1 1 1    5   10   23 o 8.511230 3.927025   5.447420   308.1 -0.8720922 1.563751          ?        ? 
1 1 1    5   10   24 o 28.37399 2.914585   30.68352   142.1   8.811138 1.653968          ?        ? 
1 1 1    5   11    0 o 228.9292 2.325611   316.4051   180.0   524.3680 10.64554   524.3680 10.64554 
1 1 1    5   11    1 o 458.5121 3.036649   608.1241   132.0   2103.938 27.84681          ?        ? 
1 1 1    5   11    2 o 354.7572 2.403180   187.3096    70.0   1259.091 17.05091          ?        ? 
1 1 1    5   11    3 o 230.5409 1.813140   303.4669    45.9   531.6154 8.360056          ?        ? 
1 1 1    5   11    4 o 197.0363 1.579641   268.7699    47.2   388.2915 6.224934          ?        ? 
1 1 1    5   11    5 o 134.5677 1.162056   176.9653   355.3   181.0945 3.127503          ?        ? 
1 1 1    5   11    6 o 469.3421 3.258111   743.2518    23.9   2203.626 30.58337          ?        ? 
1 1 1    5   11    7 o 76.04356 1.008422   32.98152   245.6   57.82874 1.533679          ?        ? 
1 1 1    5   11    8 o 162.4915 1.489806   123.7870   323.2   264.0635 4.841615          ?        ? 
1 1 1    5   11    9 o 55.00020 1.093529   56.37424   151.2   30.25258 1.202886          ?        ? 
1 1 1    5   11   10 o 471.2146 3.535537   428.7564    56.4   2223.173 33.31994          ?        ? 
1 1 1    5   11   11 o 158.9209 1.494895   160.9243    31.1   252.6361 4.751399          ?        ? 
1 1 1    5   11   12 o 245.5175 1.874017   266.5942   159.5   603.1871 9.202076          ?        ? 
1 1 1    5   11   13 o 136.6374 1.265501   148.3164    57.0   186.7781 3.458297          ?        ? 
1 1 1    5   11   14 o 154.6729 1.312363   204.7914   332.1   239.4043 4.059740          ?        ? 
1 1 1    5   11   15 o 177.4888 1.575710   198.8788   104.3   315.3967 5.593419          ?        ? 
1 1 1    5   11   16 o 39.67458 1.402245   17.91236   279.8   15.75780 1.112669          ?        ? 
1 1 1    5   11   17 o 67.95846 1.084144   59.14447   246.0   46.22089 1.473535          ?        ? 
1 1 1    5   11   18 o 72.90633 1.196182   77.99921    52.9   53.22770 1.744184          ?        ? 
1 1 1    5   11   19 o 42.69119 1.444043   46.04728    64.5   18.28386 1.232958          ?        ? 
1 1 1    5   11   20 o 29.61846 1.827572   20.51153    86.8   8.841210 1.082597          ?        ? 
1 1 1    5   11   21 o 16.25379 3.522032   17.75713   275.5   2.856854 1.112669          ?        ? 
1 1 1    5   11   22 o 19.20837 3.131151   27.45477    95.0   3.879307 1.202886          ?        ? 
1 1 1    5   11   23 o 34.50634 2.048016   29.07467    77.1   12.26943 1.413391          ?        ? 
1 1 1    5   11   24 o 10.23161 4.308468   11.77619    77.1  0.7518036 1.503607          ?        ? 
1 1 1    5   12    0 o 263.1330 2.617707   284.5244    -0.0   692.7720 13.77304   692.7720 13.77304 
1 1 1    5   12    1 o 167.0887 1.277837   144.8759    88.8   279.2198 4.270245          ?        ? 
1 1 1    5   12    2 o 126.0865 1.097119   120.7782   285.1   158.9914 2.766637          ?        ? 
1 1 1    5   12    3 o 383.1054 2.574661   463.6813   143.6   1468.303 19.72733          ?        ? 
1 1 1    5   12    4 o 409.3364 2.861485   434.5862   145.8   1676.191 23.42620          ?        ? 
1 1 1    5   12    5 o 583.2608 3.933926   704.9132     8.1   3403.776 45.89009          ?        ? 
1 1 1    5   12    6 o 511.3422 3.516851   563.3051    19.2   2615.916 35.96629          ?        ? 
1 1 1    5   12    7 o 242.0283 1.845120   219.7845   236.2   585.8655 8.931427          ?        ? 
1 1 1    5   12    8 o 85.92008 1.050004   108.7421   176.7   73.82712 1.804329          ?        ? 
1 1 1    5   12    9 o 340.2813 2.704256   277.3666   297.1   1158.559 18.40415          ?        ? 
1 1 1    5   12   10 o 154.4666 1.469863   231.9502   274.6   238.6525 4.540894          ?        ? 
1 1 1    5   12   11 o 108.8242 1.188249   78.53693   356.6   118.4542 2.586205          ?        ? 
1 1 1    5   12   12 o 60.34130 0.9219800   36.78730   102.5   36.41737 1.112669          ?        ? 
1 1 1    5   12   13 o 80.32130 0.9921552   112.6219   330.2   64.53483 1.593824          ?        ? 
1 1 1    5   12   14 o 15.39392 2.441885   4.130906    28.1   2.375700 0.7518036          ?        ? 
1 1 1    5   12   15 o 85.28610 1.040179   89.58000   275.2   72.77459 1.774257          ?        ? 
1 1 1    5   12   16 o 84.50269 1.049823   108.9696   192.2   71.45142 1.774257          ?        ? 
1 1 1    5   12   17 o 88.95260 1.200146   81.51034    89.3   79.21003 2.135122          ?        ? 
1 1 1    5   12   18 o 20.22446 2.602110   25.32855   138.0   4.119884 1.052525          ?        ? 
1 1 1    5   12   19 o 54.83467 1.179092   50.67285   183.0   30.13229 1.293102          ?        ? 
1 1 1    5   12   20 o 47.71044 1.260611   50.56332    89.3   22.85483 1.202886          ?        ? 
1 1 1    5   12   21 o 29.58249 1.931450   37.37456   333.6   8.871283 1.142741          ?        ? 
1 1 1    5   12   22 o 25.64440 2.755749   26.65111   276.6   6.856449 1.413391          ?        ? 
1 1 1    5   12   23 f 20.98650 3.295734   19.33912   142.8   4.781471 1.383319          ?        ? 
1 1 1    5   12   24 o 30.33745 2.329449   27.51449    64.3   9.803518 1.413391          ?        ? 
1 1 1    5   13    0 o 236.9966 2.417791   486.5313   180.0   561.9581 11.45749   561.9581 11.45749 
1 1 1    5   13    1 o 293.7736 1.991000   391.7737   146.3   863.2510 11.69806          ?        ? 
1 1 1    5   13    2 o 28.49403 0.8970765   120.0067   147.6   8.119479 0.5112265          ?        ? 
1 1 1    5   13    3 o 28.38843 0.9004134   60.94062   207.1   8.059335 0.5112265          ?        ? 
1 1 1    5   13    4 o 93.62550 0.9635883   201.5396   281.6   87.66030 1.804329          ?        ? 
1 1 1    5   13    5 o 273.2310 2.052643   347.1212   264.5   746.6613 11.21691          ?        ? 
1 1 1    5   13    6 o 300.6834 2.250284   333.2198   187.1   904.2995 13.53246          ?        ? 
1 1 1    5   13    7 o 129.4182 1.196676   127.7242    92.6   167.5018 3.097431          ?        ? 
1 1 1    5   13    8 o 171.1832 1.607401   204.2650   258.0   293.0831 5.503202          ?        ? 
1 1 1    5   13    9 f 65.87061 1.095681   80.05319   253.3   43.39410 1.443463          ?        ? 
1 1 1    5   13   10 o 169.3358 1.598300   138.7163   275.6   286.8281 5.412986          ?        ? 
1 1 1    5   13   11 o 61.81734 1.070229   33.44638   233.9   38.22169 1.323174          ?        ? 
1 1 1    5   13   12 o 165.4604 1.508511   178.9023    20.3   273.9272 4.991976          ?        ? 
1 1 1    5   13   13 o 57.16404 1.025832   38.49118     6.7   32.68842 1.172814          ?        ? 
1 1 1    5   13   14 o 65.24345 0.9448902   78.27419    73.2   42.58216 1.232958          ?        ? 
1 1 1    5   13   15 o 24.62241 1.893065   25.36756   296.1   6.074574 0.9322364          ?        ? 
1 1 1    5   13   16 o 52.80799 1.081978   49.00647   134.1   27.90695 1.142741          ?        ? 
1 1 1    5   13   17 o 75.37061 1.137123   90.93764   110.2   56.86643 1.714112          ?        ? 
1 1 1    5   13   18 o 20.89056 2.231239   24.53212   210.9   4.390533 0.9322364          ?        ? 
1 1 1    5   13   19 o 86.50547 1.147189   75.83102    38.9   74.99992 1.984761          ?        ? 
1 1 1    5   13   20 o 9.113441 3.630894   6.427904   135.6  0.4811543 0.9923807          ?        ? 
1 1 1    5   13   21 o 32.80733 1.741595   34.35286    80.1   10.88612 1.142741          ?        ? 
1 1 1    5   13   22 o 19.23059 2.814780   19.99099   155.5   3.879307 1.082597          ?        ? 
1 1 1    5   13   23 o 26.53249 2.550169   19.85248   328.9   7.427820 1.353247          ?        ? 
1 1 1    5   13   24 o 18.90371 3.550968   17.35664   148.0   4.210100 1.293102          ?        ? 
1 1 1    5   14    0 o 240.9520 2.434266   314.9287   180.0   580.8435 11.72814   580.8435 11.72814 
1 1 1    5   14    1 o 53.27985 0.7055234   201.8467    15.8   28.38811 0.7518036          ?        ? 
1 1 1    5   14    2 o 108.7651 1.036827   207.0150    15.2   118.3038 2.255411          ?        ? 
1 1 1    5   14    3 o 85.05956 0.9368869   75.43066   353.3   72.35358 1.593824          ?        ? 
1 1 1    5   14    4 o 222.7363 1.633649   202.5745   231.9   496.1603 7.277459          ?        ? 
1 1 1    5   14    5 o 305.2995 2.073435   341.2573   231.6   932.2365 12.66037          ?        ? 
1 1 1    5   14    6 o 370.9875 2.699289   473.1579   241.7   1376.763 20.02805          ?        ? 
1 1 1    5   14    7 o 40.14650 1.198496   78.03110   296.4   16.11867 0.9623086          ?        ? 
1 1 1    5   14    8 o 148.3250 1.510450   229.0814   286.7   220.0379 4.480750          ?        ? 
1 1 1    5   14    9 o 191.9905 1.738632   227.2473    70.9   368.7146 6.676016          ?        ? 
1 1 1    5   14   10 o 128.1352 1.314269   157.5099   116.2   164.2240 3.368080          ?        ? 
1 1 1    5   14   11 o 238.8918 2.039286   237.6621    27.4   571.1302 9.743376          ?        ? 
1 1 1    5   14   12 o 51.31625 1.201333   29.64332   340.8   26.34320 1.232958          ?        ? 
1 1 1    5   14   13 o 37.46189 1.444932   46.47182   301.8   14.04369 1.082597          ?        ? 
1 1 1    5   14   14 o 93.52319 1.061107   119.3412   195.4   87.50994 1.984761          ?        ? 
1 1 1    5   14   15 o 31.80984 1.607133   46.42504    35.3   10.13431 1.022453          ?        ? 
1 1 1    5   14   16 o 39.93753 1.317714   52.16796   343.9   15.96831 1.052525          ?        ? 
1 1 1    5   14   17 o 46.56345 1.259372   56.79857   162.0   21.71209 1.172814          ?        ? 
1 1 1    5   14   18 o 15.30737 3.334217   23.39523   245.0   2.465916 0.9923807          ?        ? 
1 1 1    5   14   19 o 16.59555 2.718091   22.18288    29.8   2.796710 0.9021643          ?        ? 
1 1 1    5   14   20 o 40.19242 1.346768   45.74945    17.9   16.23896 1.082597          ?        ? 
1 1 1    5   14   21 o 55.13402 1.199962   60.91723    44.0   30.58337 1.323174          ?        ? 
1 1 1    5   14   22 o 19.30154 2.570730   19.04716    31.9   3.879307 0.9923807          ?        ? 
1 1 1    5   14   23 o 13.48074 3.687154   8.623755    22.9   2.105050 1.022453          ?        ? 
1 1 1    5   14   24 o 24.22444 2.420724   19.45561   270.7   6.315150 1.172814          ?        ? 
1 1 1    5   15    0 o 373.9273 3.402501   334.4043     0.0   1398.866 25.44103   1398.866 25.44103 
1 1 1    5   15    1 o 232.8987 1.639838   305.4053   255.5   542.4714 7.638325          ?        ? 
1 1 1    5   15    2 o 214.5826 1.541568   189.0732    62.3   460.4948 6.615872          ?        ? 
1 1 1    5   15    3 o 625.9008 3.951799   777.7221    46.2   3919.633 49.46868          ?        ? 
1 1 1    5   15    4 o 243.7777 1.751696   188.4448   266.3   594.3459 8.540489          ?        ? 
1 1 1    5   15    5 o 290.6425 1.986582   345.5701    71.7   844.8769 11.54770          ?        ? 
1 1 1    5   15    6 o 258.5856 1.837457   335.4168   308.4   668.7744 9.502798          ?        ? 
1 1 1    5   15    7 o 78.78108 1.068810   147.8746    54.8   62.06890 1.684040          ?        ? 
1 1 1    5   15    8 o 305.2104 2.468157   315.0201   149.7   932.0260 15.06614          ?        ? 
1 1 1    5   15    9 o 191.5942 1.812859   255.0294    25.9   367.2109 6.946666          ?        ? 
1 1 1    5   15   10 o 139.5941 1.400266   185.9138   135.8   194.9276 3.909379          ?        ? 
1 1 1    5   15   11 o 222.8573 1.922881   241.7787    16.5   497.0324 8.570561          ?        ? 
1 1 1    5   15   12 o 177.1117 1.630003   197.3180   253.1   313.9231 5.773852          ?        ? 
1 1 1    5   15   13 o 122.9105 1.284502   113.6645   273.5   151.1727 3.157575          ?        ? 
1 1 1    5   15   14 o 47.72551 1.260213   52.56642   153.6   22.79469 1.202886          ?        ? 
1 1 1    5   15   15 o 73.79372 1.079918   85.44131   226.8   54.49073 1.593824          ?        ? 
1 1 1    5   15   16 o 70.77734 1.040965   65.50385   312.4   50.13026 1.473535          ?        ? 
1 1 1    5   15   17 o 23.72453 2.154843   6.010123   244.7   5.653563 1.022453          ?        ? 
1 1 1    5   15   18 o 62.32440 1.182150   70.66277   312.5   38.91335 1.473535          ?        ? 
1 1 1    5   15   19 o 48.75523 1.202757   45.34458   279.3   23.84721 1.172814          ?        ? 
1 1 1    5   15   20 o 44.74817 1.243257   57.04128   340.7   20.11827 1.112669          ?        ? 
1 1 1    5   15   21 o 32.92532 1.598352   38.79753   194.3   10.97633 1.052525          ?        ? 
1 1 1    5   15   22 o 40.41825 1.413645   50.93076    81.7   16.53968 1.142741          ?        ? 
1 1 1    5   15   23 o 19.19751 2.897953   24.23006   131.8   3.969523 1.112669          ?        ? 
1 1 1    5   16    0 o 54.14122 1.111923   46.58054     0.0   29.35041 1.202886   29.35041 1.202886 
1 1 1    5   16    1 o 323.8244 2.186985   345.3626   269.4   1048.796 14.16398          ?        ? 
1 1 1    5   16    2 o 378.8504 2.444823   341.3237   301.6   1435.584 18.52444          ?        ? 
1 1 1    5   16    3 o 89.75554 0.9213737   140.1167   244.5   80.56327 1.653968          ?        ? 
1 1 1    5   16    4 o 175.2947 1.363838   242.7102   198.1   307.3073 4.781471          ?        ? 
1 1 1    5   16    5 o 202.1778 1.494848   235.3843   291.3   408.8008 6.044501          ?        ? 
1 1 1    5   16    6 o 135.5791 1.164478   238.9126   191.9   183.8310 3.157575          ?        ? 
1 1 1    5   16    7 o 413.6467 2.947988   415.4221    23.6   1712.097 24.38851          ?        ? 
1 1 1    5   16    8 o 110.7875 1.140047   110.1121    38.1   122.7545 2.526060          ?        ? 
1 1 1    5   16    9 o 125.6951 1.375669   142.9632   118.5   158.0291 3.458297          ?        ? 
1 1 1    5   16   10 o 133.4140 1.408780   150.0549   199.1   178.0572 3.759018          ?        ? 
1 1 1    5   16   11 o 82.35177 1.205051   87.18303   278.4   67.84276 1.984761          ?        ? 
1 1 1    5   16   12 o 75.63236 1.153068   85.45191    46.3   57.22729 1.744184          ?        ? 
1 1 1    5   16   13 o 125.4224 1.366672   143.0581    58.4   157.4277 3.428224          ?        ? 
1 1 1    5   16   14 o 196.5066 1.721630   217.2012    73.2   386.6977 6.766232          ?        ? 
1 1 1    5   16   15 o 151.0007 1.443854   156.8356    69.8   228.2776 4.360461          ?        ? 
1 1 1    5   16   16 o 35.84697 1.510026   28.42848   222.5   12.87088 1.082597          ?        ? 
1 1 1    5   16   17 o 48.58099 1.238021   50.20499   302.3   23.63671 1.202886          ?        ? 
1 1 1    5   16   18 o 40.60084 1.481356   29.82938   183.3   16.53968 1.202886          ?        ? 
1 1 1    5   16   19 o 28.11740 1.871662   30.27490   159.0   7.969118 1.052525          ?        ? 
1 1 1    5   16   20 o 21.12624 2.277520   26.72453   211.5   4.540894 0.9623086          ?        ? 
1 1 1    5   16   21 f 18.08638 2.743448   9.641411   102.5   3.398152 0.9923807          ?        ? 
1 1 1    5   16   22 o 24.78180 2.244933   20.68823   113.3   6.345222 1.112669          ?        ? 
1 1 1    5   16   23 o 22.34981 2.421938   28.32760   146.2   5.292697 1.082597          ?        ? 
1 1 1    5   17    0 o 430.4196 3.836385   362.4858   180.0   1853.587 33.01921   1853.587 33.01921 
1 1 1    5   17    1 o 349.3858 2.280893   352.9613   255.0   1220.959 15.93824          ?        ? 
1 1 1    5   17    2 o 379.0034 2.404163   321.4016   170.6   1436.787 18.22372          ?        ? 
1 1 1    5   17    3 o 550.8007 3.565194   517.1354   216.3   3035.512 39.27422          ?        ? 
1 1 1    5   17    4 o 107.1494 1.024395   145.6435   118.3   114.8154 2.195267          ?        ? 
1 1 1    5   17    5 o 191.1209 1.486921   215.9166   201.2   365.3164 5.683635          ?        ? 
1 1 1    5   17    6 o 198.5874 1.491588   171.7091   189.6   394.4262 5.924213          ?        ? 
1 1 1    5   17    7 o 259.7442 1.846627   279.4468   300.9   674.8790 9.593014          ?        ? 
1 1 1    5   17    8 o 176.1523 1.544987   180.1967   309.4   310.3746 5.443058          ?        ? 
1 1 1    5   17    9 o 167.3890 1.598923   151.3537    32.5   280.3025 5.352841          ?        ? 
1 1 1    5   17   10 o 102.2111 1.220996   114.3113   198.4   104.5007 2.495988          ?        ? 
1 1 1    5   17   11 o 173.7808 1.600680   176.8795   281.2   302.1950 5.563347          ?        ? 
1 1 1    5   17   12 o 102.2580 1.249845   94.53071   121.4   104.6210 2.556132          ?        ? 
1 1 1    5   17   13 o 97.25085 1.221429   107.2365   103.6   94.63705 2.375700          ?        ? 
1 1 1    5   17   14 o 129.8214 1.308780   139.7462    21.8   168.7047 3.398152          ?        ? 
1 1 1    5   17   15 o 57.06638 1.264723   67.95721   268.1   32.59821 1.443463          ?        ? 
1 1 1    5   17   16 o 93.60954 1.156503   108.3072    46.9   87.72045 2.165194          ?        ? 
1 1 1    5   17   17 o 42.95895 1.365040   36.59309   317.9   18.49437 1.172814          ?        ? 
1 1 1    5   17   18 o 39.89407 1.469910   34.79638    16.7   15.96831 1.172814          ?        ? 
1 1 1    5   17   19 o 28.95576 1.765544   31.92270   318.4   8.450273 1.022453          ?        ? 
1 1 1    5   17   20 o 12.44324 3.710584   13.66964    11.5   1.653968 0.9923807          ?        ? 
1 1 1    5   17   21 o 29.63896 1.775577   35.76070   311.9   8.931427 1.052525          ?        ? 
1 1 1    5   17   22 o 15.41105 3.314776   20.63939    71.3   2.646349 0.9923807          ?        ? 
1 1 1    5   17   23 o 6.172503 2.971941   5.565751   326.3  -1.323174 1.082597          ?        ? 
1 1 1    5   18    0 o 415.3773 3.714643   470.2346   180.0   1726.322 30.85402   1726.322 30.85402 
1 1 1    5   18    1 o 166.5155 1.309326   191.9671    12.9   277.2952 4.360461          ?        ? 
1 1 1    5   18    2 o 159.4121 1.235618   262.9443    51.8   254.1397 3.939451          ?        ? 
1 1 1    5   18    3 o 265.9196 1.995992   329.7752   193.9   707.2667 10.61547          ?        ? 
1 1 1    5   18    4 o 158.3123 1.301189   165.6280    74.5   250.6513 4.119884          ?        ? 
1 1 1    5   18    5 o 108.7914 1.050397   152.9925   302.3   118.3640 2.285483          ?        ? 
1 1 1    5   18    6 o 276.0918 1.960575   277.5331   186.6   762.5093 10.82597          ?        ? 
1 1 1    5   18    7 o 127.6240 1.154591   168.0809   293.3   162.9008 2.947070          ?        ? 
1 1 1    5   18    8 f 165.5605 1.371370   195.9128   355.8   274.1678 4.540894          ?        ? 
1 1 1    5   18    9 o 102.1248 1.163136   142.2258    12.5   104.3203 2.375700          ?        ? 
1 1 1    5   18   10 o 153.4278 1.489615   159.2506    48.7   235.5250 4.570966          ?        ? 
1 1 1    5   18   11 o 151.7482 1.535828   150.2460   140.3   230.4428 4.661182          ?        ? 
1 1 1    5   18   12 o 66.80437 1.237919   69.77328   143.5   44.65714 1.653968          ?        ? 
1 1 1    5   18   13 o 130.6874 1.426666   126.4824    25.5   170.9601 3.728946          ?        ? 
1 1 1    5   18   14 o 75.65654 1.212321   68.96378   306.5   57.28744 1.834401          ?        ? 
1 1 1    5   18   15 f 87.04765 1.174590   102.3931   148.3   75.84195 2.044906          ?        ? 
1 1 1    5   18   16 o 60.12284 1.350482   68.16795    48.5   36.20686 1.623896          ?        ? 
1 1 1    5   18   17 o 7.992031 3.513616   5.590301   174.5 -0.2706493 1.082597          ?        ? 
1 1 1    5   18   18 o 38.02843 1.502483   48.81779    89.4   14.52485 1.142741          ?        ? 
1 1 1    5   18   19 o 29.48517 1.886829   23.18449   232.8   8.781067 1.112669          ?        ? 
1 1 1    5   18   20 o 30.95756 1.894228   17.00766    36.1   9.713303 1.172814          ?        ? 
1 1 1    5   18   21 o 15.28739 3.156673   16.58230   200.7   2.556132 0.9322364          ?        ? 
1 1 1    5   18   22 o 32.51660 1.710925   32.64195   346.7   10.82597 1.112669          ?        ? 
1 1 1    5   18   23 o 16.96641 3.218390   15.24495   234.5   3.307936 1.052525          ?        ? 
1 1 1    5   19    0 o 50.41653 1.314221   100.9653     0.0   25.47111 1.323174   25.47111 1.323174 
1 1 1    5   19    1 o 401.8965 2.521623   368.9774   160.6   1615.716 20.26863          ?        ? 
1 1 1    5   19    2 o 121.4600 1.052253   123.3200    46.8   147.5340 2.556132          ?        ? 
1 1 1    5   19    3 o 297.8788 1.978704   248.1260   208.3   887.5192 11.78828          ?        ? 
1 1 1    5   19    4 o 326.2867 2.258038   298.7473   215.4   1064.975 14.73535          ?        ? 
1 1 1    5   19    5 o 348.2485 2.383330   331.7623    23.3   1213.321 16.59982          ?        ? 
1 1 1    5   19    6 o 285.2307 2.050632   274.4557     4.9   813.9026 11.69806          ?        ? 
1 1 1    5   19    7 o 106.0022 1.092221   166.7648   252.1   112.3796 2.315555          ?        ? 
1 1 1    5   19    8 o 184.4565 1.434674   172.4734     4.4   340.3565 5.292697          ?        ? 
1 1 1    5   19    9 o 142.8911 1.357435   159.2188   187.8   204.2500 3.879307          ?        ? 
1 1 1    5   19   10 o 90.12769 1.101083   63.42234   144.4   81.25494 1.984761          ?        ? 
1 1 1    5   19   11 o 78.51695 1.206456   94.94958   155.1   61.67797 1.894545          ?        ? 
1 1 1    5   19   12 o 83.68330 1.185877   96.62745   114.0   70.06810 1.984761          ?        ? 
1 1 1    5   19   13 o 15.80405 3.915805   40.49319   323.9   2.616277 1.232958          ?        ? 
1 1 1    5   19   14 o 77.86798 1.235821   82.58166    54.1   60.68559 1.924617          ?        ? 
1 1 1    5   19   15 o 56.76889 1.350810   53.85932    22.3   32.26741 1.533679          ?        ? 
1 1 1    5   19   16 o 42.24779 1.601559   57.15437   152.8   17.89293 1.353247          ?        ? 
1 1 1    5   19   17 o 30.50717 1.922194   29.25189    27.9   9.352437 1.172814          ?        ? 
1 1 1    5   19   18 o 75.16543 1.120222   73.46733   106.9   56.65592 1.684040          ?        ? 
1 1 1    5   19   19 f 39.45967 1.447987   36.34973   157.2   15.66759 1.142741          ?        ? 
1 1 1    5   19   20 o 19.08388 2.993998   18.87850   284.7   3.789090 1.142741          ?        ? 
1 1 1    5   19   21 o 53.98936 1.392503   49.12284     6.4   29.50077 1.503607          ?        ? 
1 1 1    5   19   22 o 24.94602 2.109605   29.64293   286.2   6.465511 1.052525          ?        ? 
1 1 1    5   19   23 o 8.414162 3.603560   4.467047   131.9  0.3007214 1.082597          ?        ? 
1 1 1    5   20    0 o 63.46884 1.185447   96.30701   180.0   40.32675 1.503607   40.32675 1.503607 
1 1 1    5   20    1 o 212.6834 1.527055   201.9865   350.5   452.4054 6.495584          ?        ? 
1 1 1    5   20    2 o 85.62231 0.9482902   66.71416   221.7   73.31589 1.623896          ?        ? 
1 1 1    5   20    3 o 362.6244 2.317871   407.3956    72.0   1315.446 16.81033          ?        ? 
1 1 1    5   20    4 o 264.2268 1.889277   235.9482   348.0   698.3654 9.983953          ?        ? 
1 1 1    5   20    5 o 97.78490 1.060991   100.0387   275.6   95.62942 2.074978          ?        ? 
1 1 1    5   20    6 o 197.2385 1.570399   189.8430   272.4   389.1335 6.194862          ?        ? 
1 1 1    5   20    7 o 245.2204 1.827233   294.6313   258.4   601.6233 8.961499          ?        ? 
1 1 1    5   20    8 o 53.89223 1.060210   63.64321   334.3   29.04969 1.142741          ?        ? 
1 1 1    5   20    9 f 64.85426 0.9969295   60.27705   164.6   42.07093 1.293102          ?        ? 
1 1 1    5   20   10 o 22.05499 2.249787   47.27548   294.2   4.871688 0.9923807          ?        ? 
1 1 1    5   20   11 o 174.1314 1.502473   198.2677   324.8   303.4881 5.232553          ?        ? 
1 1 1    5   20   12 o 119.6342 1.281974   135.6383   324.4   143.2336 3.067359          ?        ? 
1 1 1    5   20   13 o 157.1255 1.578962   163.6260   307.2   247.2532 4.961904          ?        ? 
1 1 1    5   20   14 o 80.79794 1.246835   83.40611    37.7   65.34677 2.014834          ?        ? 
1 1 1    5   20   15 f 72.54178 1.243648   88.85627   287.8   52.68640 1.804329          ?        ? 
1 1 1    5   20   16 o 50.38400 1.432462   37.77740   176.2   25.44103 1.443463          ?        ? 
1 1 1    5   20   17 o 68.02964 1.304032   52.58772    73.4   46.40132 1.774257          ?        ? 
1 1 1    5   20   18 o 34.28494 1.534967   28.37552   299.3   11.81835 1.052525          ?        ? 
1 1 1    5   20   19 o 18.68622 2.735847   20.04546   267.5   3.578585 1.022453          ?        ? 
1 1 1    5   20   20 o 47.71902 1.417932   56.34047   304.3   23.00519 1.353247          ?        ? 
1 1 1    5   20   21 o 20.86352 2.810681   25.21479    35.6   4.570966 1.172814          ?        ? 
1 1 1    5   20   22 o 28.93653 1.922603   31.45858    69.9   8.660777 1.112669          ?        ? 
1 1 1    5   21    0 o 58.76196 1.306430   64.67374     0.0   34.58297 1.533679   34.58297 1.533679 
1 1 1    5   21    1 o 561.1309 3.376298   587.5839     3.5   3151.320 37.89090          ?        ? 
1 1 1    5   21    2 o 280.5146 1.881422   343.6892    69.1   787.1083 10.55532          ?        ? 
1 1 1    5   21    3 o 167.5087 1.274634   186.2467   294.6   280.6333 4.270245          ?        ? 
1 1 1    5   21    4 o 105.9751 1.049935   93.55584   242.2   112.3195 2.225339          ?        ? 
1 1 1    5   21    5 o 35.06733 1.329209   39.82617   197.5   12.29951 0.9322364          ?        ? 
1 1 1    5   21    6 o 143.8237 1.244088   148.1868    70.9   206.8964 3.578585          ?        ? 
1 1 1    5   21    7 o 163.9687 1.494724   155.5514     1.5   268.9653 4.901759          ?        ? 
1 1 1    5   21    8 o 102.7266 1.083137   112.9846    63.8   105.5532 2.225339          ?        ? 
1 1 1    5   21    9 o 30.81760 1.512507   50.08488   148.3   9.502798 0.9322364          ?        ? 
1 1 1    5   21   10 o 33.29823 1.580452   69.35450    21.5   11.09662 1.052525          ?        ? 
1 1 1    5   21   11 o 105.7495 1.237017   109.6056   125.5   111.8985 2.616277          ?        ? 
1 1 1    5   21   12 o 40.57806 1.333969   62.71926   337.0   16.47953 1.082597          ?        ? 
1 1 1    5   21   13 o 68.04939 1.148983   86.89571   227.8   46.34118 1.563751          ?        ? 
1 1 1    5   21   14 f 55.02311 1.366342   59.27647   114.3   30.31272 1.503607          ?        ? 
1 1 1    5   21   15 o 88.97754 1.351898   88.34646   132.2   79.30025 2.405771          ?        ? 
1 1 1    5   21   16 o 30.73978 2.152218   48.51341   308.2   9.502798 1.323174          ?        ? 
1 1 1    5   21   17 f 38.37598 1.645600   46.19691   330.6   14.79550 1.263030          ?        ? 
1 1 1    5   21   18 o 14.38476 3.881879   6.885658   344.1   2.225339 1.142741          ?        ? 
1 1 1    5   21   19 o 61.44258 1.199116   52.73115   312.3   37.95105 1.473535          ?        ? 
1 1 1    5   21   20 o 7.319034 3.334487   8.860207   148.0 -0.5713707 1.082597          ?        ? 
1 1 1    5   21   21 o 10.32649 3.914563   12.50371   255.3  0.9623086 1.112669          ?        ? 
1 1 1    5   21   22 f 19.27754 3.041917   13.79870   140.9   4.089812 1.172814          ?        ? 
1 1 1    5   22    0 f 410.5408 3.681482   469.7992    -0.0   1686.927 30.22251   1686.927 30.22251 
1 1 1    5   22    1 o 285.1738 1.961407   297.3163   234.2   813.5417 11.18684          ?        ? 
1 1 1    5   22    2 o 143.6506 1.214185   183.4652   162.4   206.3851 3.488369          ?        ? 
1 1 1    5   22    3 o 165.2662 1.282831   115.7771     2.3   273.1754 4.240172          ?        ? 
1 1 1    5   22    4 o 147.6525 1.293294   181.0353   104.9   218.0531 3.819162          ?        ? 
1 1 1    5   22    5 f 234.4294 1.763823   258.3812    12.7   549.8090 8.269840          ?        ? 
1 1 1    5   22    6 o 156.2308 1.318525   154.8738   300.3   244.1557 4.119884          ?        ? 
1 1 1    5   22    7 o 69.94154 0.9889105   93.81161    77.8   48.92738 1.383319          ?        ? 
1 1 1    5   22    8 o 241.7605 1.859603   257.1450   159.6   584.9935 8.991571          ?        ? 
1 1 1    5   22    9 o 76.58449 1.001299   51.68211   164.2   58.67076 1.533679          ?        ? 
1 1 1    5   22   10 o 134.0428 1.312432   139.8541    62.5   179.8014 3.518441          ?        ? 
1 1 1    5   22   11 o 82.39865 1.094878   88.98572   132.6   67.93298 1.804329          ?        ? 
1 1 1    5   22   12 o 14.97006 3.392416   27.28256   320.0   2.345627 0.9923807          ?        ? 
1 1 1    5   22   13 o 71.22021 1.140053   62.35973    30.5   50.76178 1.623896          ?        ? 
1 1 1    5   22   14 o 41.80129 1.510755   50.98158   332.2   17.50199 1.263030          ?        ? 
1 1 1    5   22   15 o 96.07681 1.079854   81.22921    54.1   92.41170 2.074978          ?        ? 
1 1 1    5   22   16 o 59.26609 1.395375   54.65569   315.7   35.21448 1.653968          ?        ? 
1 1 1    5   22   17 o 11.46950 4.067723   12.87410   140.5   1.202886 1.172814          ?        ? 
1 1 1    5   22   18 o 41.46671 1.595466   36.98001   328.1   17.32155 1.323174          ?        ? 
1 1 1    5   22   19 o 32.27929 1.816666   33.31146    77.4   10.55532 1.172814          ?        ? 
1 1 1    5   22   20 o 10.09801 3.851522   14.64825    86.0  0.8720922 1.082597          ?        ? 
1 1 1    5   22   21 o 37.16047 1.780352   34.28241   211.0   14.16398 1.323174          ?        ? 
1 1 1    5   22   22 o 7.181853 3.362101   7.566292   187.6 -0.7818757 1.202886          ?        ? 
1 1 1    5   23    0 f 385.4737 3.448816   298.0112   180.0   1487.188 26.58378   1487.188 26.58378 
1 1 1    5   23    1 o 95.79715 0.9731360   157.5162   245.0   91.78019 1.864473          ?        ? 
1 1 1    5   23    2 o 289.4180 1.974206   331.1855   271.0   837.9904 11.42741          ?        ? 
1 1 1    5   23    3 o 251.2764 1.741309   232.1785   258.0   631.6353 8.750995          ?        ? 
1 1 1    5   23    4 o 138.6484 1.279680   180.7331   222.2   192.2813 3.548513          ?        ? 
1 1 1    5   23    5 o 40.70022 1.256078   38.83497    25.8   16.56975 1.022453          ?        ? 
1 1 1    5   23    6 o 120.1664 1.163682   117.1643    97.8   144.4365 2.796710          ?        ? 
1 1 1    5   23    7 o 94.36536 1.067571   139.8568   116.0   89.07370 2.014834          ?        ? 
1 1 1    5   23    8 o 47.10018 1.181173   60.49718    49.5   22.19324 1.112669          ?        ? 
1 1 1    5   23    9 o 114.8319 1.191553   134.7871   246.0   131.9265 2.736565          ?        ? 
1 1 1    5   23   10 o 211.4358 1.749407   209.8937   313.2   447.5938 7.397748          ?        ? 
1 1 1    5   23   11 o 20.41509 2.504160   18.86453    62.7   4.180028 1.022453          ?        ? 
1 1 1    5   23   12 o 86.58694 1.163474   73.70703   338.9   75.03000 2.014834          ?        ? 
1 1 1    5   23   13 o 37.48318 1.604568   39.72520    71.5   14.07376 1.202886          ?        ? 
1 1 1    5   23   14 o 10.91448 3.855233   5.513407   263.9   1.052525 1.052525          ?        ? 
1 1 1    5   23   15 o 73.18372 1.212194   73.78605   115.0   53.64870 1.774257          ?        ? 
1 1 1    5   23   16 o 13.74003 3.879310   18.20459   187.7   1.984761 1.112669          ?        ? 
1 1 1    5   23   17 o 32.52452 1.664278   36.59169   220.6   10.64554 1.082597          ?        ? 
1 1 1    5   23   18 o 66.59169 1.332191   64.60541   260.7   44.59699 1.774257          ?        ? 
1 1 1    5   23   19 f 16.28501 3.842932   6.758802   341.4   2.947070 1.232958          ?        ? 
1 1 1    5   23   20 o 18.05257 3.373518   10.71222   351.6   3.578585 1.172814          ?        ? 
1 1 1    5   23   21 o 22.50372 2.672638   20.78076   114.7   5.382914 1.202886          ?        ? 
1 1 1    5   23   22 o 14.54146 3.788377   13.16299    12.3   2.586205 1.112669          ?        ? 
1 1 1    5   24    0 o 151.8801 1.673550   56.95451   180.0   230.8037 5.082192   230.8037 5.082192 
1 1 1    5   24    1 o 312.0970 2.081271   372.8286   260.4   974.6382 12.99117          ?        ? 
1 1 1    5   24    2 o 383.3597 2.490586   367.0727   209.9   1471.039 19.09581          ?        ? 
1 1 1    5   24    3 o 124.5197 1.074698   128.8879   150.3   155.0820 2.676421          ?        ? 
1 1 1    5   24    4 o 137.6812 1.124856   137.0181   217.7   189.6049 3.097431          ?        ? 
1 1 1    5   24    5 o 161.1832 1.287341   175.0050     4.0   259.8835 4.149956          ?        ? 
1 1 1    5   24    6 o 56.53110 1.063915   75.09790   254.3   31.96669 1.202886          ?        ? 
1 1 1    5   24    7 o 119.3531 1.247200   109.5171   287.4   142.5119 2.977142          ?        ? 
1 1 1    5   24    8 o 124.4285 1.244663   116.3752   207.3   154.9016 3.097431          ?        ? 
1 1 1    5   24    9 o 131.9827 1.184815   148.9669   244.8   174.2981 3.127503          ?        ? 
1 1 1    5   24   10 o 73.46701 1.166586   53.21674   108.7   54.00957 1.714112          ?        ? 
1 1 1    5   24   11 o 110.3511 1.226310   157.3185    34.8   121.8824 2.706493          ?        ? 
1 1 1    5   24   12 o 125.7324 1.291549   124.6904    43.2   158.2396 3.247792          ?        ? 
1 1 1    5   24   13 o 63.11230 1.262689   49.43899   303.9   39.87567 1.593824          ?        ? 
1 1 1    5   24   14 o 81.59560 1.197791   99.58776     6.0   66.66994 1.954689          ?        ? 
1 1 1    5   24   15 o 46.14534 1.498872   53.98142   325.2   21.35122 1.383319          ?        ? 
1 1 1    5   24   16 o 90.28336 1.215765   100.9077   247.8   81.73608 2.195267          ?        ? 
1 1 1    5   24   17 o 74.28928 1.335833   69.64027   290.7   55.45303 1.984761          ?        ? 
1 1 1    5   24   18 o 11.03313 3.859345   14.02166   186.7   1.172814 1.052525          ?        ? 
1 1 1    5   24   19 o 24.94587 2.169893   18.67766   201.8   6.375295 1.082597          ?        ? 
1 1 1    5   24   20 o 17.31638 3.156015   22.72524   186.2   3.277864 1.052525          ?        ? 
1 1 1    5   24   21 o 13.13659 3.649029   10.26023   109.8   2.014834 0.9923807          ?        ? 
1 1 1    5   25    0 o 61.45002 1.445435   84.08741   360.0   37.83076 1.774257   37.83076 1.774257 
1 1 1    5   25    1 o 23.32444 1.676087   33.44124   266.3   5.443058 0.7818757          ?        ? 
1 1 1    5   25    2 o 210.8271 1.668875   176.9857   358.5   444.7069 7.036882          ?        ? 
1 1 1    5   25    3 o 104.8437 1.032582   99.85048   138.1   109.9438 2.165194          ?        ? 
1 1 1    5   25    4 o 201.4785 1.477647   244.3265   328.3   406.1243 5.954284          ?        ? 
1 1 1    5   25    5 o 83.33471 1.064536   98.94580   311.1   69.46665 1.774257          ?        ? 
1 1 1    5   25    6 o 133.5636 1.328398   127.4668    22.0   178.4782 3.548513          ?        ? 
1 1 1    5   25    7 o 60.16092 1.074703   75.23228    57.7   36.20686 1.293102          ?        ? 
1 1 1    5   25    8 o 39.14731 1.344313   61.78871   350.1   15.33679 1.052525          ?        ? 
1 1 1    5   25    9 o 96.01481 1.033571   106.2904   350.5   92.23127 1.984761          ?        ? 
1 1 1    5   25   10 o 38.82954 1.587655   28.33723   104.1   15.09622 1.232958          ?        ? 
1 1 1    5   25   11 o 85.08089 1.184070   103.7191   320.7   72.44379 2.014834          ?        ? 
1 1 1    5   25   12 o 72.24045 1.186394   90.71130   185.4   52.23531 1.714112          ?        ? 
1 1 1    5   25   13 o 14.41041 4.022225   6.050440    17.3   2.165194 1.202886          ?        ? 
1 1 1    5   25   14 o 90.09491 1.151551   99.74944     3.8   81.28500 2.074978          ?        ? 
1 1 1    5   25   15 o 98.10905 1.302700   100.0946   124.9   96.50151 2.556132          ?        ? 
1 1 1    5   25   16 o 34.81446 1.813944   43.62304   112.2   12.20929 1.263030          ?        ? 
1 1 1    5   25   17 o 12.03962 3.802414   3.516948   239.0   1.503607 1.022453          ?        ? 
1 1 1    5   25   18 o 19.89962 2.871265   24.28061    56.0   4.089812 1.142741          ?        ? 
1 1 1    5   25   19 o 29.99096 1.955279   28.30241   158.7   9.202076 1.172814          ?        ? 
1 1 1    5   25   20 o 16.98399 3.646266   10.41264   134.0   3.277864 1.202886          ?        ? 
1 1 1    5   25   21 o 25.19133 2.208437   21.90269   295.7   6.706088 1.112669          ?        ? 
1 1 1    5   26    0 f 452.1465 3.994611   436.6850   180.0   2048.094 36.11665   2048.094 36.11665 
1 1 1    5   26    1 o 171.8485 1.347439   198.6158   136.6   295.4288 4.631110          ?        ? 
1 1 1    5   26    2 o 114.3723 1.078022   109.8609   110.2   130.8439 2.465916          ?        ? 
1 1 1    5   26    3 o 81.73510 0.9198051   122.5824   328.5   66.82030 1.503607          ?        ? 
1 1 1    5   26    4 o 72.59813 0.9320120   112.3878   315.3   52.71647 1.353247          ?        ? 
1 1 1    5   26    5 o 131.6291 1.210845   132.4939   302.1   173.3358 3.187647          ?        ? 
1 1 1    5   26    6 o 78.73214 1.031279   80.49313   127.1   62.00876 1.623896          ?        ? 
1 1 1    5   26    7 o 116.6919 1.249872   102.9328   209.0   136.2569 2.916998          ?        ? 
1 1 1    5   26    8 o 46.35399 1.297500   55.12239   160.0   21.50158 1.202886          ?        ? 
1 1 1    5   26    9 o 71.48079 1.072791   85.33784   134.4   51.12265 1.533679          ?        ? 
1 1 1    5   26   10 o 94.92155 1.267242   80.66160   300.9   90.18636 2.405771          ?        ? 
1 1 1    5   26   11 o 44.82747 1.375226   23.78399   247.9   20.11827 1.232958          ?        ? 
1 1 1    5   26   12 o 64.59252 1.280309   65.85310   200.8   41.77021 1.653968          ?        ? 
1 1 1    5   26   13 o 11.18858 4.187854   12.45227   122.1  0.9623086 1.263030          ?        ? 
1 1 1    5   26   14 o 28.41413 2.169621   29.28985   247.8   8.119479 1.232958          ?        ? 
1 1 1    5   26   15 o 17.59459 3.284045   14.90141   175.4   3.247792 1.112669          ?        ? 
1 1 1    5   26   16 o 53.55571 1.347628   49.16376    36.8   28.80912 1.443463          ?        ? 
1 1 1    5   26   17 o 8.595914 3.639497   13.35815    43.1  0.1202886 1.082597          ?        ? 
1 1 1    5   26   18 o 16.33216 3.424026   14.21775   322.1   2.916998 1.082597          ?        ? 
1 1 1    5   26   19 o 6.118376 2.942080   8.489470    45.2  -1.413391 1.052525          ?        ? 
1 1 1    5   26   20 o 27.44153 2.301312   30.01383   158.1   7.878902 1.263030          ?        ? 
1 1 1    5   26   21 o 28.83909 1.981237   32.23223   217.8   8.720922 1.142741          ?        ? 
1 1 1    5   27    0 o 77.62936 1.279134   95.48733   360.0   60.32472 1.984761   60.32472 1.984761 
1 1 1    5   27    1 o 275.8411 1.978709   270.4325   346.1   761.6372 10.91619          ?        ? 
1 1 1    5   27    2 o 199.4104 1.538214   185.5883   325.5   397.8846 6.134717          ?        ? 
1 1 1    5   27    3 o 170.9189 1.310783   165.7865   300.1   292.2712 4.480750          ?        ? 
1 1 1    5   27    4 o 122.9538 1.076155   131.3141   305.0   151.2328 2.646349          ?        ? 
1 1 1    5   27    5 o 105.8758 1.079323   121.7003    78.9   112.1390 2.285483          ?        ? 
1 1 1    5   27    6 o 45.76748 1.248421   29.60672   223.1   20.96028 1.142741          ?        ? 
1 1 1    5   27    7 o 89.23229 1.078431   87.39700   193.6   79.66111 1.924617          ?        ? 
1 1 1    5   27    8 o 149.9373 1.323728   142.5619   212.1   224.9998 3.969523          ?        ? 
1 1 1    5   27    9 o 97.40109 1.096046   81.01142   248.2   94.93777 2.135122          ?        ? 
1 1 1    5   27   10 f 56.86021 1.216421   35.82137   174.4   32.35763 1.383319          ?        ? 
1 1 1    5   27   11 o 60.38546 1.344608   56.77491   198.8   36.50758 1.623896          ?        ? 
1 1 1    5   27   12 o 21.09182 2.922834   16.52510   162.9   4.480750 1.232958          ?        ? 
1 1 1    5   27   13 o 47.78678 1.415921   28.53179    86.9   22.88490 1.353247          ?        ? 
1 1 1    5   27   14 o 12.45306 4.082784   2.471585    29.4   1.533679 1.172814          ?        ? 
1 1 1    5   27   15 o 57.76693 1.327472   60.81474    43.9   33.50037 1.533679          ?        ? 
1 1 1    5   27   16 o 49.62291 1.484733   43.42460   268.5   24.77945 1.473535          ?        ? 
1 1 1    5   27   17 o 24.26368 2.416809   32.16263   271.7   6.014429 1.172814          ?        ? 
1 1 1    5   27   18 o 14.69355 3.768351   14.50628   113.5   2.405771 1.112669          ?        ? 
1 1 1    5   27   19 o 23.24541 2.457994   23.13210   322.2   5.623491 1.142741          ?        ? 
1 1 1    5   27   20 o 6.541174 3.135695   7.988497   146.1  -1.353247 1.172814          ?        ? 
1 1 1    5   28    0 o 7.188817 4.447793   64.46349     0.0  0.4210100 1.232958  0.4210100 1.232958 
1 1 1    5   28    1 o 14.64813 2.873950   22.34629   196.5   2.225339 0.8119479          ?        ? 
1 1 1    5   28    2 o 78.00536 0.9445090   93.83595     7.8   60.86602 1.473535          ?        ? 
1 1 1    5   28    3 o 40.69738 1.145327   45.08426    55.2   16.56975 0.9322364          ?        ? 
1 1 1    5   28    4 o 90.26025 0.9495389   111.3161   311.3   81.49551 1.714112          ?        ? 
1 1 1    5   28    5 o 47.63458 1.199487   35.94234   163.3   22.70447 1.142741          ?        ? 
1 1 1    5   28    6 o 51.34119 1.142176   54.41791   179.3   26.37327 1.172814          ?        ? 
1 1 1    5   28    7 o 157.0491 1.359525   169.5365   121.4   246.8622 4.270245          ?        ? 
1 1 1    5   28    8 o 22.90748 2.231701   26.81498   152.9   5.262625 1.022453          ?        ? 
1 1 1    5   28    9 o 90.95656 1.124111   104.3384   109.4   82.78861 2.044906          ?        ? 
1 1 1    5   28   10 o 113.6783 1.150737   89.38553   206.1   129.3403 2.616277          ?        ? 
1 1 1    5   28   11 o 101.3064 1.276427   107.3356   218.5   102.7565 2.586205          ?        ? 
1 1 1    5   28   12 o 17.22742 3.850725   38.81702    37.5   3.127503 1.293102          ?        ? 
1 1 1    5   28   13 o 27.75559 2.437791   29.93227   124.8   7.758613 1.353247          ?        ? 
1 1 1    5   28   14 o 60.82588 1.359592   50.43316    67.2   37.10903 1.653968          ?        ? 
1 1 1    5   28   15 f 29.31974 2.153890   50.45620    82.3   8.690849 1.263030          ?        ? 
1 1 1    5   28   16 o 43.18431 1.566826   48.30912   209.4   18.79509 1.353247          ?        ? 
1 1 1    5   28   17 o 7.963120 3.565642   9.575121   310.1 -0.3909379 1.172814          ?        ? 
1 1 1    5   28   18 o 18.61093 3.070082   13.97100   245.7   3.668802 1.142741          ?        ? 
1 1 1    5   28   19 o 17.61669 3.451767   16.33604   196.7   3.488369 1.172814          ?        ? 
1 1 1    5   28   20 o 9.687165 3.849312   13.66529   286.5  0.8420200 1.112669          ?        ? 
1 1 1    5   29    0 o 4.488356 3.167276   14.04166   360.0  -1.052525 1.052525  -1.052525 1.052525 
1 1 1    5   29    1 o 121.4370 1.101979   115.1515   201.8   147.5340 2.676421          ?        ? 
1 1 1    5   29    2 o 131.9719 1.219093   137.1055   266.7   174.2681 3.217719          ?        ? 
1 1 1    5   29    3 o 137.5577 1.180520   140.6206   208.5   189.3342 3.247792          ?        ? 
1 1 1    5   29    4 o 149.0406 1.220717   166.8369   114.7   222.2632 3.638730          ?        ? 
1 1 1    5   29    5 o 102.5641 1.114173   112.0799   198.9   105.2525 2.285483          ?        ? 
1 1 1    5   29    6 o 24.92793 1.930182   20.59627   119.7   6.224934 0.9623086          ?        ? 
1 1 1    5   29    7 o 78.79500 1.087704   65.65541   254.7   62.12905 1.714112          ?        ? 
1 1 1    5   29    8 o 80.21370 1.087211   71.79809   344.2   64.38446 1.744184          ?        ? 
1 1 1    5   29    9 o 60.44355 1.194059   51.76012    33.1   36.56773 1.443463          ?        ? 
1 1 1    5   29   10 o 54.99907 1.257584   47.05410   102.0   30.28265 1.383319          ?        ? 
1 1 1    5   29   11 o 34.71106 1.905984   41.26970   148.7   12.08900 1.323174          ?        ? 
1 1 1    5   29   12 o 20.53282 3.295326   9.579543   186.1   4.270245 1.353247          ?        ? 
1 1 1    5   29   13 o 38.99140 1.773876   43.67844    47.2   15.27665 1.383319          ?        ? 
1 1 1    5   29   14 o 45.88598 1.572880   50.52375   177.3   21.17079 1.443463          ?        ? 
1 1 1    5   29   15 o 39.60799 1.708300   42.64994   290.9   15.81795 1.353247          ?        ? 
1 1 1    5   29   16 o 12.72815 4.186161   16.55615   245.0   1.684040 1.232958          ?        ? 
1 1 1    5   29   17 o 29.24767 2.262017   26.67697    83.4   8.781067 1.323174          ?        ? 
1 1 1    5   29   18 o 16.30451 3.839978   10.99652   134.5   3.007215 1.232958          ?        ? 
1 1 1    5   29   19 o 35.08860 1.928328   36.60261   109.3   12.72052 1.353247          ?        ? 
1 1 1    5   29   20 o 32.61996 2.074261   26.67047   217.5   11.21691 1.353247          ?        ? 
1 1 1    5   30    0 f 28.18353 2.159071   28.88397   180.0   8.089407 1.202886   8.089407 1.202886 
1 1 1    5   30    1 o 209.9843 1.575325   211.4381   189.9   441.3689 6.615872          ?        ? 
1 1 1    5   30    2 o 68.87511 0.9168987   58.98075     0.5   47.45385 1.263030          ?        ? 
1 1 1    5   30    3 o 64.94175 0.9492799   101.5028   106.5   42.19122 1.232958          ?        ? 
1 1 1    5   30    4 f 88.99831 0.9292132   71.43892   359.2   79.24010 1.653968          ?        ? 
1 1 1    5   30    5 f 44.83408 1.341486   44.32185   209.8   20.11827 1.202886          ?        ? 
1 1 1    5   30    6 o 62.47707 1.131128   55.42439    96.3   39.06371 1.413391          ?        ? 
1 1 1    5   30    7 o 49.36347 1.248857   48.90568   113.2   24.38851 1.232958          ?        ? 
1 1 1    5   30    8 o 82.29890 1.096205   47.53475   158.4   67.78262 1.804329          ?        ? 
1 1 1    5   30    9 o 85.16527 1.129931   81.45404   282.2   72.59415 1.924617          ?        ? 
1 1 1    5   30   10 o 46.03613 1.437104   34.25628   175.5   21.23093 1.323174          ?        ? 
1 1 1    5   30   11 o 71.56825 1.260565   67.36815    95.4   51.30308 1.804329          ?        ? 
1 1 1    5   30   12 o 106.2070 1.302474   100.6057   246.5   113.0412 2.766637          ?        ? 
1 1 1    5   30   13 o 7.735312 3.552966   14.08986   350.5 -0.9021643 1.263030          ?        ? 
1 1 1    5   30   14 o 35.31153 1.830992   33.64204   169.5   12.57016 1.293102          ?        ? 
1 1 1    5   30   15 o 11.82233 4.307759   14.98961   252.5   1.263030 1.323174          ?        ? 
1 1 1    5   30   16 o 33.40846 1.890285   32.32193    62.0   11.33720 1.263030          ?        ? 
1 1 1    5   30   17 o 23.95964 2.635745   25.04477   100.5   5.984357 1.263030          ?        ? 
1 1 1    5   30   18 o 29.82021 2.269009   31.55285    33.8   9.232149 1.353247          ?        ? 
1 1 1    5   30   19 o 8.785597 3.872561   12.32071   288.5       0.06 1.323174          ?        ? 
1 1 1    5   31    0 o 72.96637 1.340455   80.26585   180.0   53.31791 1.954689   53.31791 1.954689 
1 1 1    5   31    1 o 45.66917 1.152336   37.39884   257.9   20.87007 1.052525          ?        ? 
1 1 1    5   31    2 f 49.73484 1.088369   35.94561   154.5   24.74938 1.082597          ?        ? 
1 1 1    5   31    3 o 44.19768 1.156682   47.98751   129.2   19.54689 1.022453          ?        ? 
1 1 1    5   31    4 o 156.3333 1.221481   138.0212   225.2   244.6068 3.819162          ?        ? 
1 1 1    5   31    5 o 202.6257 1.461861   192.3833   110.2   411.0862 5.924213          ?        ? 
1 1 1    5   31    6 o 10.93560 3.855989   10.13951     7.3   1.052525 1.052525          ?        ? 
1 1 1    5   31    7 o 108.7746 1.174967   91.46852    87.8   118.4241 2.556132          ?        ? 
1 1 1    5   31    8 o 39.77890 1.511965   54.18317   158.8   15.84802 1.202886          ?        ? 
1 1 1    5   31    9 o 89.92784 1.120250   79.70937    70.0   80.95422 2.014834          ?        ? 
1 1 1    5   31   10 o 141.2772 1.298441   126.3549   321.0   199.9196 3.668802          ?        ? 
1 1 1    5   31   11 o 54.44055 1.436201   37.68667   147.9   29.71128 1.563751          ?        ? 
1 1 1    5   31   12 o 39.14161 1.805484   30.47547   355.9   15.39694 1.413391          ?        ? 
1 1 1    5   31   13 o 66.48653 1.356913   63.52259    71.5   44.38649 1.804329          ?        ? 
1 1 1    5   31   14 o 57.27692 1.391331   51.62975    33.9   32.98914 1.593824          ?        ? 
1 1 1    5   31   15 o 28.86784 2.187608   33.19618    14.9   8.480345 1.263030          ?        ? 
1 1 1    5   31   16 o 33.49791 1.885237   34.76488     9.8   11.42741 1.263030          ?        ? 
1 1 1    5   31   17 o 37.07966 1.946435   33.64201   132.8   14.07376 1.443463          ?        ? 
1 1 1    5   31   18 o 43.18829 1.705943   36.41088   194.7   19.12588 1.473535          ?        ? 
1 1 1    5   31   19 o 39.13398 1.921102   38.96582   133.4   15.99838 1.503607          ?        ? 
1 1 1    5   32    0 o 16.15765 4.621543   9.974381    -0.0   3.187647 1.293102   3.187647 1.293102 
1 1 1    5   32    1 o 97.29464 1.081792   93.45905   144.8   94.72726 2.105050          ?        ? 
1 1 1    5   32    2 o 111.6209 1.077653   100.2348   141.2   124.6791 2.405771          ?        ? 
1 1 1    5   32    3 o 43.36939 1.213442   65.09193   351.2   18.82516 1.052525          ?        ? 
1 1 1    5   32    4 o 85.60100 1.001222   96.24003    80.3   73.31589 1.714112          ?        ? 
1 1 1    5   32    5 o 143.7671 1.213201   131.3175   300.4   206.8663 3.488369          ?        ? 
1 1 1    5   32    6 o 107.5827 1.132080   100.3272   230.6   115.8379 2.435844          ?        ? 
1 1 1    5   32    7 o 103.9255 1.186386   103.6215   273.7   108.1094 2.465916          ?        ? 
1 1 1    5   32    8 o 31.31330 1.872709   24.09976   168.3   9.833591 1.172814          ?        ? 
1 1 1    5   32    9 o 58.83939 1.252167   68.78264   244.7   34.67318 1.473535          ?        ? 
1 1 1    5   32   10 o 104.9600 1.117391   106.8660   164.5   110.3347 2.345627          ?        ? 
1 1 1    5   32   11 o 49.51320 1.488022   37.20799   269.3   24.59902 1.473535          ?        ? 
1 1 1    5   32   12 o 41.39862 1.816012   34.59544    49.9   17.26141 1.503607          ?        ? 
1 1 1    5   32   13 o 9.165226 3.882458   5.170466    76.4  0.1202886 1.232958          ?        ? 
1 1 1    5   32   14 o 39.74168 1.816057   50.40257   225.3   15.96831 1.443463          ?        ? 
1 1 1    5   32   15 o 22.95347 2.685777   22.74600   161.8   5.443058 1.232958          ?        ? 
1 1 1    5   32   16 o 24.71469 2.676899   31.09670    98.9   6.375295 1.323174          ?        ? 
1 1 1    5   32   17 f 34.63968 2.040133   34.91225   102.1   12.35965 1.413391          ?        ? 
1 1 1    5   32   18 o 24.95973 2.771101   27.49729   103.4   6.706088 1.383319          ?        ? 
1 1 1    5   33    0 o 54.99652 1.588648   29.15717     0.0   30.34279 1.744184   30.34279 1.744184 
1 1 1    5   33    1 o 43.12383 1.324954   41.79990   214.8   18.61466 1.142741          ?        ? 
1 1 1    5   33    2 o 87.56476 0.9444256   71.51264   290.2   76.71404 1.653968          ?        ? 
1 1 1    5   33    3 o 71.16147 1.035346   73.77589    89.8   50.67156 1.473535          ?        ? 
1 1 1    5   33    4 o 96.00183 1.065035   102.9297    68.4   92.23127 2.044906          ?        ? 
1 1 1    5   33    5 o 133.0650 1.141279   130.2151   222.1   177.2151 3.037287          ?        ? 
1 1 1    5   33    6 o 105.7860 1.179735   98.28539   258.0   112.0187 2.495988          ?        ? 
1 1 1    5   33    7 o 18.06114 3.372089   9.357021   328.9   3.398152 1.172814          ?        ? 
1 1 1    5   33    8 o 101.8214 1.151834   99.54419   270.1   103.8090 2.345627          ?        ? 
1 1 1    5   33    9 o 16.43579 3.820086   22.39839   303.2   2.856854 1.232958          ?        ? 
1 1 1    5   33   10 o 23.22189 2.525233   27.48890   138.8   5.443058 1.172814          ?        ? 
1 1 1    5   33   11 o 106.9356 1.349843   100.6924   282.0   114.7553 2.886926          ?        ? 
1 1 1    5   33   12 o 39.12015 1.844910   26.78231   266.5   15.42701 1.443463          ?        ? 
1 1 1    5   33   13 o 47.17796 1.625419   59.10828   169.8   22.43382 1.533679          ?        ? 
1 1 1    5   33   14 o 27.21585 2.486137   34.13680   300.8   7.578181 1.353247          ?        ? 
1 1 1    5   33   15 o 12.35456 4.236643   16.19258   174.6   1.593824 1.263030          ?        ? 
1 1 1    5   33   16 o 10.69254 4.277481   12.11973   233.4  0.8420200 1.383319          ?        ? 
1 1 1    5   33   17 o 17.36925 3.904208   17.32805    85.7   3.518441 1.323174          ?        ? 
1 1 1    5   33   18 o 11.10049 4.216502   9.163655   107.8   1.353247 1.293102          ?        ? 
1 1 1    5   34    0 o 36.05151 2.057667   37.38328   180.0   13.14153 1.473535   13.14153 1.473535 
1 1 1    5   34    1 o 130.2014 1.131735   123.7903   356.6   169.6670 2.947070          ?        ? 
1 1 1    5   34    2 o 179.9058 1.362313   131.3828    14.0   324.0574 4.901759          ?        ? 
1 1 1    5   34    3 o 114.6560 1.101582   112.7307    23.8   131.5656 2.526060          ?        ? 
1 1 1    5   34    4 o 103.4990 1.075053   83.19764    95.1   107.2072 2.225339          ?        ? 
1 1 1    5   34    5 o 12.31184 3.785804   16.35855    48.4   1.533679 1.022453          ?        ? 
1 1 1    5   34    6 o 50.42771 1.341769   63.18652   293.1   25.47111 1.353247          ?        ? 
1 1 1    5   34    7 o 57.52277 1.254688   55.30801   103.7   33.13950 1.443463          ?        ? 
1 1 1    5   34    8 o 27.98622 2.202795   23.24297   233.0   7.878902 1.232958          ?        ? 
1 1 1    5   34    9 o 34.34644 1.751107   32.22054    51.8   11.84843 1.202886          ?        ? 
1 1 1    5   34   10 o 55.49142 1.300618   64.91080     3.3   30.88409 1.443463          ?        ? 
1 1 1    5   34   11 o 23.82150 2.777270   36.64923    16.0   5.773852 1.323174          ?        ? 
1 1 1    5   34   12 o 16.10797 4.236902   6.914213   241.5   2.826782 1.383319          ?        ? 
1 1 1    5   34   13 o 14.04483 4.245288   15.43904   186.4   2.135122 1.293102          ?        ? 
1 1 1    5   34   14 o 10.48687 4.188032   5.799561   301.4  0.7518036 1.323174          ?        ? 
1 1 1    5   34   15 o 17.37581 3.977959   10.97233   140.5   3.428224 1.353247          ?        ? 
1 1 1    5   34   16 o 19.34057 3.789047   20.49322    53.0   4.240172 1.413391          ?        ? 
1 1 1    5   34   17 o 8.292850 3.746908   5.750207   294.5 -0.3007214 1.323174          ?        ? 
1 1 1    5   34   18 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1    5   35    0 o 53.23541 1.641617   19.83619     0.0   28.44825 1.744184   28.44825 1.744184 
1 1 1    5   35    1 o 82.51775 1.020411   98.02237   300.9   68.14348 1.684040          ?        ? 
1 1 1    5   35    2 o 92.05189 1.029064   65.42136   317.9   84.80345 1.894545          ?        ? 
1 1 1    5   35    3 o 95.68195 1.037166   77.35870    23.8   91.62983 1.984761          ?        ? 
1 1 1    5   35    4 o 45.67975 1.349567   63.70395   191.1   20.90014 1.232958          ?        ? 
1 1 1    5   35    5 o 74.90908 1.063839   74.52291   103.9   56.17477 1.593824          ?        ? 
1 1 1    5   35    6 o 60.86486 1.284609   54.26064    15.2   37.10903 1.563751          ?        ? 
1 1 1    5   35    7 o 50.40874 1.401930   55.48656   326.0   25.47111 1.413391          ?        ? 
1 1 1    5   35    8 o 48.87500 1.507453   44.91867   137.7   23.96750 1.473535          ?        ? 
1 1 1    5   35    9 o 71.20117 1.203711   67.45050   261.3   50.82193 1.714112          ?        ? 
1 1 1    5   35   10 o 26.41508 2.390737   24.86161   181.0   7.066954 1.263030          ?        ? 
1 1 1    5   35   11 o 46.76704 1.671852   62.86118   128.6   22.04288 1.563751          ?        ? 
1 1 1    5   35   12 o 60.55558 1.440152   58.32407    80.1   36.92860 1.744184          ?        ? 
1 1 1    5   35   13 o 60.35690 1.419980   62.96597   301.7   36.74816 1.714112          ?        ? 
1 1 1    5   35   14 o 27.26730 2.536589   27.10370   292.0   7.698469 1.383319          ?        ? 
1 1 1    5   35   15 o 42.25650 1.707978   41.02764   284.3   18.19365 1.443463          ?        ? 
1 1 1    5   35   16 o 7.647059 3.528676   7.385664     5.3 -0.6916593 1.263030          ?        ? 
1 1 1    5   35   17 o 8.460020 3.807602   6.943520   115.6 -0.1503607 1.353247          ?        ? 
1 1 1    5   36    0 o 35.70782 2.250150   27.16728   180.0   12.93102 1.593824   12.93102 1.593824 
1 1 1    5   36    1 o 6.487189 3.048843   5.528641   260.0  -1.112669 1.022453          ?        ? 
1 1 1    5   36    2 o 54.24846 1.219550   77.07528   159.3   29.47070 1.323174          ?        ? 
1 1 1    5   36    3 o 73.87650 1.099061   83.43444   153.0   54.64109 1.623896          ?        ? 
1 1 1    5   36    4 o 26.18517 2.067195   9.289327   184.6   6.886521 1.082597          ?        ? 
1 1 1    5   36    5 o 53.14349 1.273201   64.86764   203.7   28.29789 1.353247          ?        ? 
1 1 1    5   36    6 o 10.86270 4.041527   5.722858   192.7  0.9322364 1.172814          ?        ? 
1 1 1    5   36    7 o 44.40390 1.523793   45.12625   296.2   19.78747 1.353247          ?        ? 
1 1 1    5   36    8 o 17.93357 3.564181   12.52446   127.1   3.398152 1.232958          ?        ? 
1 1 1    5   36    9 o 48.20106 1.403752   37.73716    83.7   23.33598 1.353247          ?        ? 
1 1 1    5   36   10 o 96.45024 1.262746   92.46133    59.5   93.43416 2.435844          ?        ? 
1 1 1    5   36   11 o 40.15499 1.984590   27.32393   323.4   16.32917 1.593824          ?        ? 
1 1 1    5   36   12 o 29.90532 2.212273   27.81323    32.5   9.111859 1.323174          ?        ? 
1 1 1    5   36   13 o 41.43289 1.850799   39.21003   220.2   17.47192 1.533679          ?        ? 
1 1 1    5   36   14 o 35.61640 2.068619   37.31898   111.1   13.02124 1.473535          ?        ? 
1 1 1    5   36   15 f 8.798433 3.808335   10.00731   213.7  0.1202886 1.232958          ?        ? 
1 1 1    5   36   16 o 29.77246 2.474661   27.42944   316.6   9.442654 1.473535          ?        ? 
1 1 1    5   37    0 o 29.58597 2.631347   21.49129   180.0   8.991571 1.533679   8.991571 1.533679 
1 1 1    5   37    1 o 87.72164 1.045581   79.37872    15.0   77.04484 1.834401          ?        ? 
1 1 1    5   37    2 o 43.64959 1.377889   34.11765   152.1   19.09581 1.202886          ?        ? 
1 1 1    5   37    3 o 87.06264 1.053495   68.82066   292.5   75.90209 1.834401          ?        ? 
1 1 1    5   37    4 o 82.72639 1.090540   69.19205    43.9   68.53442 1.804329          ?        ? 
1 1 1    5   37    5 o 32.87683 1.737913   27.78160   321.2   10.85604 1.142741          ?        ? 
1 1 1    5   37    6 o 83.99078 1.199437   82.18790   126.4   70.69962 2.014834          ?        ? 
1 1 1    5   37    7 o 93.51428 1.157681   93.31750   200.4   87.69038 2.165194          ?        ? 
1 1 1    5   37    8 o 52.50467 1.260054   47.27557   264.4   27.66637 1.323174          ?        ? 
1 1 1    5   37    9 o 62.52921 1.274463   58.44469   218.2   39.27422 1.593824          ?        ? 
1 1 1    5   37   10 f 15.89130 3.746752   15.27291   128.2   2.736565 1.172814          ?        ? 
1 1 1    5   37   11 o 24.84592 2.965346   31.91195   162.9   6.375295 1.473535          ?        ? 
1 1 1    5   37   12 o 43.08711 1.744846   43.13681    26.6   18.85523 1.503607          ?        ? 
1 1 1    5   37   13 o 13.66061 4.380633   14.26071   113.6   2.105050 1.353247          ?        ? 
1 1 1    5   37   14 o 27.32131 2.586608   25.48854   185.5   7.818758 1.413391          ?        ? 
1 1 1    5   37   15 o 27.75261 2.763126   28.59975   140.3   8.239767 1.533679          ?        ? 
1 1 1    5   37   16 o 27.62146 2.612938   19.62064   255.4   8.269840 1.443463          ?        ? 
1 1 1    5   38    0 o 36.29517 2.339861   26.83781     0.0   13.38210 1.684040   13.38210 1.684040 
1 1 1    5   38    1 o 40.65368 1.405459   39.30323    72.8   16.56975 1.142741          ?        ? 
1 1 1    5   38    2 o 88.17969 1.091304   75.47675   280.2   77.88686 1.924617          ?        ? 
1 1 1    5   38    3 o 115.9883 1.101892   114.6129   273.6   134.7834 2.556132          ?        ? 
1 1 1    5   38    4 o 40.07917 1.500637   46.70951     2.3   16.11867 1.202886          ?        ? 
1 1 1    5   38    5 o 70.77225 1.062286   67.61875    82.3   50.19041 1.503607          ?        ? 
1 1 1    5   38    6 o 94.38406 1.274459   82.28474   103.0   89.40448 2.405771          ?        ? 
1 1 1    5   38    7 o 33.09967 1.771640   24.37037   238.5   11.03648 1.172814          ?        ? 
1 1 1    5   38    8 o 54.66488 1.375295   46.99641   328.7   30.04207 1.503607          ?        ? 
1 1 1    5   38    9 o 112.3680 1.257824   92.74081   318.2   126.9044 2.826782          ?        ? 
1 1 1    5   38   10 o 53.20589 1.271708   42.40461   326.5   28.47832 1.353247          ?        ? 
1 1 1    5   38   11 o 18.41345 4.030209   7.393319   131.4   3.789090 1.443463          ?        ? 
1 1 1    5   38   12 o 36.78917 2.002675   24.30892   295.9   13.86326 1.473535          ?        ? 
1 1 1    5   38   13 o 59.49734 1.516310   56.41302   146.9   35.93621 1.804329          ?        ? 
1 1 1    5   38   14 o 15.65937 4.291281   16.03895    19.0   2.947070 1.383319          ?        ? 
1 1 1    5   38   15 o 14.88730 4.426005  0.3562325   168.0   2.826782 1.413391          ?        ? 
1 1 1    5   39    0 o 6.004463 4.094031   17.80840   180.0 -0.6615872 1.443463 -0.6615872 1.443463 
1 1 1    5   39    1 o 48.55322 1.269698   46.09711   155.7   23.63671 1.232958          ?        ? 
1 1 1    5   39    2 o 94.13577 1.086147   83.94363   151.1   88.80304 2.044906          ?        ? 
1 1 1    5   39    3 o 32.21433 1.633628   25.80441    58.2   10.43503 1.052525          ?        ? 
1 1 1    5   39    4 o 27.51291 2.022086   15.93905    98.3   7.638325 1.112669          ?        ? 
1 1 1    5   39    5 o 10.15774 3.818814   23.35357   146.1  0.8119479 1.052525          ?        ? 
1 1 1    5   39    6 o 7.860246 3.519603   11.24842   112.0 -0.4510822 1.142741          ?        ? 
1 1 1    5   39    7 o 36.49823 1.771459   30.31188   114.8   13.44225 1.293102          ?        ? 
1 1 1    5   39    8 o 34.48079 1.875106   26.03874   240.7   12.02886 1.293102          ?        ? 
1 1 1    5   39    9 o 17.57922 3.786181   20.06617   155.6   3.368080 1.293102          ?        ? 
1 1 1    5   39   10 o 33.99672 1.990260   36.94120   341.5   11.78828 1.353247          ?        ? 
1 1 1    5   39   11 o 7.708392 3.593373   14.81962   157.0  -1.022453 1.353247          ?        ? 
1 1 1    5   39   12 o 9.559187 4.172051   4.489946   257.9       0.03 1.503607          ?        ? 
1 1 1    5   39   13 o 15.11636 4.344118   10.24786   281.0   2.736565 1.383319          ?        ? 
1 1 1    5   39   14 o 36.47616 2.143525   35.25344   272.8   13.95348 1.563751          ?        ? 
1 1 1    5   39   15 o 42.05957 2.001970   35.39881   241.0   18.61466 1.684040          ?        ? 
1 1 1    5   40    0 o 44.24413 1.876427   35.68261   180.0   19.75740 1.653968   19.75740 1.653968 
1 1 1    5   40    1 o 57.55601 1.175591   56.59814   203.2   33.22972 1.353247          ?        ? 
1 1 1    5   40    2 o 38.95652 1.428092   25.69882   135.1   15.24658 1.112669          ?        ? 
1 1 1    5   40    3 o 30.81106 1.756832   31.72169    83.6   9.562942 1.082597          ?        ? 
1 1 1    5   40    4 o 56.23591 1.256662   41.05452   173.6   31.75618 1.413391          ?        ? 
1 1 1    5   40    5 o 44.18496 1.429253   34.03003   224.6   19.63711 1.263030          ?        ? 
1 1 1    5   40    6 o 109.1033 1.171428   92.13725   203.2   119.5368 2.556132          ?        ? 
1 1 1    5   40    7 o 64.21343 1.264452   51.47845   200.8   41.46949 1.623896          ?        ? 
1 1 1    5   40    8 o 16.96811 3.891240   8.515945   177.4   3.157575 1.293102          ?        ? 
1 1 1    5   40    9 o 44.25395 1.528956   40.25993   276.3   19.81754 1.353247          ?        ? 
1 1 1    5   40   10 o 38.14070 1.813441   30.83578   307.2   14.82557 1.383319          ?        ? 
1 1 1    5   40   11 o 12.91588 4.476631   11.77649   224.9   1.804329 1.413391          ?        ? 
1 1 1    5   40   12 o 10.38731 4.337696   17.52225   248.5  0.6315150 1.503607          ?        ? 
1 1 1    5   40   13 o 7.478512 3.523903   8.608097    80.5  -1.142741 1.383319          ?        ? 
1 1 1    5   40   14 o 20.67814 3.775936   20.63932   215.4   5.112265 1.503607          ?        ? 
1 1 1    5   41    0 f 36.72231 2.437679   51.87478     0.0   13.77304 1.774257   13.77304 1.774257 
1 1 1    5   41    1 o 37.34525 1.570231   43.78939   128.2   14.04369 1.172814          ?        ? 
1 1 1    5   41    2 o 19.41622 2.710428   31.91715    44.9   3.849235 1.052525          ?        ? 
1 1 1    5   41    3 o 22.47572 2.475270   27.03877   183.1   5.142337 1.112669          ?        ? 
1 1 1    5   41    4 f 55.39054 1.221550   32.81907    88.4   30.82395 1.353247          ?        ? 
1 1 1    5   41    5 o 68.85289 1.091898   65.25234    78.2   47.60421 1.503607          ?        ? 
1 1 1    5   41    6 o 41.62362 1.661699   35.10682   233.9   17.50199 1.383319          ?        ? 
1 1 1    5   41    7 o 26.29031 2.459275   22.21523   309.4   7.097026 1.293102          ?        ? 
1 1 1    5   41    8 o 22.62018 2.791821   23.61243   142.4   5.322770 1.263030          ?        ? 
1 1 1    5   41    9 o 22.09623 2.789973   9.299459   142.6   5.112265 1.232958          ?        ? 
1 1 1    5   41   10 o 46.03899 1.437015   38.40611    95.2   21.47151 1.323174          ?        ? 
1 1 1    5   41   11 o 41.48905 1.920776   33.85234    41.6   17.71249 1.593824          ?        ? 
1 1 1    5   41   12 o 13.67945 4.529438   6.610349    53.7   2.255411 1.443463          ?        ? 
1 1 1    5   41   13 o 32.14275 2.479290   22.58538    32.6   11.09662 1.593824          ?        ? 
1 1 1    5   42    0 o 13.00196 5.696740   7.877293   180.0   2.526060 1.533679   2.526060 1.533679 
1 1 1    5   42    1 o 40.36867 1.489875   29.57822    21.2   16.41939 1.202886          ?        ? 
1 1 1    5   42    2 o 25.46078 2.126010   17.40471   286.2   6.585800 1.082597          ?        ? 
1 1 1    5   42    3 o 61.06957 1.132576   53.19581   342.6   37.46989 1.383319          ?        ? 
1 1 1    5   42    4 o 21.57215 2.718351   11.00272   331.6   4.781471 1.172814          ?        ? 
1 1 1    5   42    5 o 23.88024 2.329686   18.61571   168.7   5.833996 1.112669          ?        ? 
1 1 1    5   42    6 o 15.51012 3.804503  0.7097088     3.4   2.676421 1.172814          ?        ? 
1 1 1    5   42    7 o 52.86353 1.479046   47.90889    37.7   28.26782 1.563751          ?        ? 
1 1 1    5   42    8 o 35.21038 1.836252   29.78232    66.4   12.66037 1.293102          ?        ? 
1 1 1    5   42    9 o 23.56400 2.807618   28.74532    33.5   5.833996 1.323174          ?        ? 
1 1 1    5   42   10 o 26.20503 2.180386   28.78907    51.8   7.127099 1.142741          ?        ? 
1 1 1    5   42   11 o 23.96678 3.199594   23.60159    67.1   6.285078 1.533679          ?        ? 
1 1 1    5   42   12 o 13.91127 4.425821   6.650382   298.9   2.465916 1.383319          ?        ? 
1 1 1    5   43    0 o 30.47180 2.653636   15.86831   180.0   9.623086 1.593824   9.623086 1.593824 
1 1 1    5   43    1 o 43.77716 1.476915   36.05944   262.8   19.33639 1.293102          ?        ? 
1 1 1    5   43    2 o 23.50520 2.302889   17.52081   280.5   5.653563 1.082597          ?        ? 
1 1 1    5   43    3 o 20.09674 2.693464   20.69749    97.6   4.180028 1.082597          ?        ? 
1 1 1    5   43    4 f 32.12321 1.825493   31.12473   178.8   10.49518 1.172814          ?        ? 
1 1 1    5   43    5 o 9.871043 3.871902   5.639242   342.3  0.7217315 1.112669          ?        ? 
1 1 1    5   43    6 o 45.24020 1.595332   36.60709   290.9   20.77985 1.443463          ?        ? 
1 1 1    5   43    7 f 62.51127 1.298882   55.51805   333.9   39.48473 1.623896          ?        ? 
1 1 1    5   43    8 f 26.27768 2.460458   19.88898   286.7   7.187243 1.293102          ?        ? 
1 1 1    5   43    9 o 12.91373 4.236905   8.017678   264.8   1.924617 1.263030          ?        ? 
1 1 1    5   43   10 o 12.21083 4.134799   7.745809   108.8   1.714112 1.202886          ?        ? 
1 1 1    5   43   11 o 27.23329 2.760605   29.33157   205.9   8.089407 1.503607          ?        ? 
1 1 1    5   44    0 o 9.420058 5.275401   12.01092   180.0   1.353247 1.473535   1.353247 1.473535 
1 1 1    5   44    1 o 45.38953 1.391323   33.75882    68.3   20.80992 1.263030          ?        ? 
1 1 1    5   44    2 o 87.54513 1.167915   66.18387    48.6   77.19520 2.044906          ?        ? 
1 1 1    5   44    3 o 47.14645 1.371368   40.76345    94.5   22.46389 1.293102          ?        ? 
1 1 1    5   44    4 o 22.24798 2.500608   12.13495   110.8   5.142337 1.112669          ?        ? 
1 1 1    5   44    5 o 49.57861 1.304093   35.73227   144.1   24.83959 1.293102          ?        ? 
1 1 1    5   44    6 o 31.04205 2.034386   27.82008   160.0   9.893736 1.263030          ?        ? 
1 1 1    5   44    7 o 8.040499 3.645328   6.541996   124.1 -0.4510822 1.263030          ?        ? 
1 1 1    5   44    8 o 57.46345 1.334483   45.09957    90.2   33.53044 1.533679          ?        ? 
1 1 1    5   44    9 o 9.184801 3.911583   7.679258    72.8  0.3608657 1.263030          ?        ? 
1 1 1    5   44   10 o 19.20593 3.654671   23.80754   272.3   4.360461 1.353247          ?        ? 
1 1 1    5   45    0 o 30.35179 2.767927   22.63587     0.0   9.653158 1.653968   9.653158 1.653968 
1 1 1    5   45    1 f 34.31368 1.752779   17.45082   349.8   11.99879 1.202886          ?        ? 
1 1 1    5   45    2 o 39.00026 1.619258   35.00939   209.1   15.45708 1.263030          ?        ? 
1 1 1    5   45    3 o 33.77836 1.780557   31.14319   146.8   11.63792 1.202886          ?        ? 
1 1 1    5   45    4 o 29.49957 1.987849   27.15532   130.2   8.931427 1.172814          ?        ? 
1 1 1    5   45    5 o 51.46560 1.314710   36.64862   250.3   26.82435 1.353247          ?        ? 
1 1 1    5   45    6 o 19.54762 3.596039   14.76778   169.1   4.330389 1.353247          ?        ? 
1 1 1    5   45    7 o 10.12832 4.043397   3.123732   325.6  0.8420200 1.232958          ?        ? 
1 1 1    5   45    8 o 25.16905 2.748055   17.81663    34.0   6.856449 1.383319          ?        ? 
1 1 1    5   45    9 o 7.952578 3.628805   12.23058   120.1 -0.3909379 1.293102          ?        ? 
1 1 1    5   46    0 o 59.56550 1.694303   57.55516    -0.0   35.93621 2.014834   35.93621 2.014834 
1 1 1    5   46    1 o 16.25941 3.351223   13.72426    45.4   2.947070 1.052525          ?        ? 
1 1 1    5   46    2 o 26.39372 2.164798   25.82226   347.4   7.217315 1.142741          ?        ? 
1 1 1    5   46    3 o 11.59090 3.976308   11.34324    61.4   1.473535 1.112669          ?        ? 
1 1 1    5   46    4 o 21.03205 2.788159   15.15710   174.7   4.721327 1.172814          ?        ? 
1 1 1    5   46    5 o 16.05747 3.641405   13.18682   159.4   2.977142 1.142741          ?        ? 
1 1 1    5   46    6 o 34.13300 1.982314   29.34213   350.6   12.11907 1.353247          ?        ? 
1 1 1    5   46    7 o 19.05501 3.603225   15.44351   163.6   4.270245 1.323174          ?        ? 
1 1 1    5   46    8 o 20.75481 3.115187   12.58735   284.8   4.841615 1.293102          ?        ? 
1 1 1    5   47    0 o 14.67111 5.507767   6.583137   180.0   3.157575 1.503607   3.157575 1.503607 
1 1 1    5   47    1 f 21.80824 2.619976   17.35682   249.7   5.052120 1.142741          ?        ? 
1 1 1    5   47    2 o 36.19675 1.744673   23.22941   299.1   13.47232 1.263030          ?        ? 
1 1 1    5   47    3 o 25.82196 2.270962   18.26383   351.7   7.006810 1.172814          ?        ? 
1 1 1    5   47    4 o 41.89476 1.543274   25.03672     8.4   18.01322 1.293102          ?        ? 
1 1 1    5   47    5 o 17.99207 3.298727   19.42317    80.3   3.728946 1.142741          ?        ? 
1 1 1    5   47    6 o 16.53583 3.957010   12.00594    36.9   3.368080 1.293102          ?        ? 
1 1 1    5   48    0 o 7.602397 4.835056   3.743882   360.0  0.6014429 1.563751  0.6014429 1.563751 
1 1 1    5   48    1 o 41.05214 1.574951   26.47183   226.1   17.35163 1.293102          ?        ? 
1 1 1    5   48    2 o 9.010584 3.745085   9.413336   168.3  0.5412986 1.112669          ?        ? 
1 1 1    5   48    3 o 35.41719 1.698167   31.61181   254.6   12.99117 1.202886          ?        ? 
1 1 1    5   48    4 o 20.62399 2.916229   9.242640   340.5   4.721327 1.202886          ?        ? 
1 1 1    6    0    0 o 139.1698 2.042965   83.42373     0.0   193.8150 5.683635   193.8150 5.683635 
1 1 1    6    0    1 o 134.5479 1.374879   87.90127     0.0   181.0945 3.698874   181.0945 3.698874 
1 1 1    6    0    2 o 190.8035 1.749779   204.6274     0.0   364.1737 6.676016   364.1737 6.676016 
1 1 1    6    0    3 o 310.4106 2.625832   451.8820     0.0   963.9325 16.29910   963.9325 16.29910 
1 1 1    6    0    4 o 53.39765 0.9016525   180.3185     0.0   28.53847 0.9623086   28.53847 0.9623086 
1 1 1    6    0    5 o 185.0471 2.040067   184.7396   180.0   342.6120 7.548109   342.6120 7.548109 
1 1 1    6    0    6 o 191.2195 2.037101   314.4054   180.0   365.8276 7.788685   365.8276 7.788685 
1 1 1    6    0    7 o 39.23877 0.9977351   161.4356   180.0   15.42701 0.7818757   15.42701 0.7818757 
1 1 1    6    0    8 o 413.9850 4.090566   546.5168     0.0   1714.834 33.86123   1714.834 33.86123 
1 1 1    6    0    9 o 98.93254 1.459749   73.15011   180.0   97.94498 2.886926   97.94498 2.886926 
1 1 1    6    0   10 o 163.7861 1.891710   268.0071   180.0   268.3939 6.194862   268.3939 6.194862 
1 1 1    6    0   11 o 108.8763 1.630426   11.71275   180.0   118.6346 3.548513   118.6346 3.548513 
1 1 1    6    0   12 o 74.96969 1.344732   83.31394     0.0   56.26498 2.014834   56.26498 2.014834 
1 1 1    6    0   13 o 10.10124 4.772973   67.76698     0.0   1.503607 1.082597   1.503607 1.082597 
1 1 1    6    0   14 o 6.654751 4.024374   28.19182   180.0  0.4510822 0.9623086  0.4510822 0.9623086 
1 1 1    6    0   15 o 61.79480 1.315269   65.28645     0.0   38.25177 1.623896   38.25177 1.623896 
1 1 1    6    0   16 o 21.15619 2.891483   21.30345     0.0   4.601038 1.202886   4.601038 1.202886 
1 1 1    6    0   17 o 16.82346 3.556601   33.11420   180.0   3.187647 1.052525   3.187647 1.052525 
1 1 1    6    0   18 o 16.06456 4.743145   26.18622   180.0   3.187647 1.323174   3.187647 1.323174 
1 1 1    6    0   19 o 16.35927 5.399401   6.411481   180.0   3.458297 1.563751   3.458297 1.563751 
1 1 1    6    0   20 o 100.7971 1.656807   105.5568     0.0   101.9145 3.338008   101.9145 3.338008 
1 1 1    6    0   21 o 14.35992 6.228110   12.34306   180.0   3.067359 1.834401   3.067359 1.834401 
1 1 1    6    0   22 o 72.49876 2.788097   70.75571     0.0   53.58856 4.029667   53.58856 4.029667 
1 1 1    6    0   23 o 7.295836 4.890060   9.075033     0.0 -0.3007214 1.924617 -0.3007214 1.924617 
1 1 1    6    0   24 x        ?      ?   9.918301   180.0          ?        ?          ?        ? 
1 1 1    6    0   25 x        ?      ?   27.07924   180.0          ?        ?          ?        ? 
1 1 1    6    1    0 o 215.3107 2.004635   66.21795     0.0   463.7425 8.630706   463.7425 8.630706 
1 1 1    6    1    1 o 573.4457 4.811474   687.6989   297.9   3291.246 55.18238          ?        ? 
1 1 1    6    1    2 o 651.7137 4.748134   831.3742   338.8   4251.149 61.88847          ?        ? 
1 1 1    6    1    3 o 243.6821 1.616635   502.1621   161.2   593.8948 7.878902          ?        ? 
1 1 1    6    1    4 o 54.83736 0.5483879   258.2749    91.5   30.07215 0.6014429          ?        ? 
1 1 1    6    1    5 o 157.8903 1.257051   298.6490   115.6   249.3281 3.969523          ?        ? 
1 1 1    6    1    6 o 400.9876 3.014807   493.1023   350.4   1608.950 24.17801          ?        ? 
1 1 1    6    1    7 o 99.14696 1.016084   98.99215    65.8   98.30584 2.014834          ?        ? 
1 1 1    6    1    8 o 411.1291 2.845351   480.7025   316.1   1690.746 23.39613          ?        ? 
1 1 1    6    1    9 o 341.4126 2.422242   394.5095    42.1   1165.927 16.53968          ?        ? 
1 1 1    6    1   10 o 158.8707 1.343937   211.8052   346.6   252.4256 4.270245          ?        ? 
1 1 1    6    1   11 o 169.0604 1.405237   227.4994   357.9   285.8658 4.751399          ?        ? 
1 1 1    6    1   12 o 153.7551 1.320196   172.9059    15.5   236.4573 4.059740          ?        ? 
1 1 1    6    1   13 f 186.0408 1.470949   243.0163     4.2   346.2507 5.473131          ?        ? 
1 1 1    6    1   14 o 152.3255 1.243748   178.1392   301.6   232.1269 3.789090          ?        ? 
1 1 1    6    1   15 f 25.94163 1.506990   25.42772     5.5   6.736160 0.7818757          ?        ? 
1 1 1    6    1   16 o 63.25271 0.9508572   76.75243   126.2   40.02603 1.202886          ?        ? 
1 1 1    6    1   17 o 86.24798 0.9937115   86.79932    21.6   74.42856 1.714112          ?        ? 
1 1 1    6    1   18 o 108.3073 1.193919   112.0341     9.9   117.4317 2.586205          ?        ? 
1 1 1    6    1   19 o 46.71871 1.190818   48.82848   198.6   21.86245 1.112669          ?        ? 
1 1 1    6    1   20 o 61.66122 1.316789   44.51226   220.6   38.13148 1.623896          ?        ? 
1 1 1    6    1   21 o 43.39973 1.628340   31.78086   291.6   18.97552 1.413391          ?        ? 
1 1 1    6    1   22 o 25.39580 2.782726   26.69469    67.3   6.645944 1.413391          ?        ? 
1 1 1    6    1   23 o 38.70655 2.175394   37.11433     7.0   15.42701 1.684040          ?        ? 
1 1 1    6    1   24 x        ?      ?   5.272776   147.0          ?        ?          ?        ? 
1 1 1    6    1   25 x        ?      ?   26.94669   245.1          ?        ?          ?        ? 
1 1 1    6    2    0 o 23.30342 0.6463293   123.0375    -0.0   5.443058 0.3007214   5.443058 0.3007214 
1 1 1    6    2    1 o 375.2495 2.283963   610.4462   347.4   1408.399 17.14112          ?        ? 
1 1 1    6    2    2 o 350.2371 2.090745   564.0629    12.5   1226.883 14.64513          ?        ? 
1 1 1    6    2    3 o 153.3240 1.255262   36.13734   176.2   235.1040 3.849235          ?        ? 
1 1 1    6    2    4 f 142.2145 0.9304076   493.3631   151.8   202.2652 2.646349          ?        ? 
1 1 1    6    2    5 o 303.2789 2.146744   276.0346   102.9   920.1475 13.02124          ?        ? 
1 1 1    6    2    6 o 228.3432 1.692308   316.9532   345.4   521.5111 7.728541          ?        ? 
1 1 1    6    2    7 o 436.2028 3.267792   583.8220    55.3   1903.627 28.50839          ?        ? 
1 1 1    6    2    8 o 157.4859 1.403493   261.9062   291.0   248.0350 4.420605          ?        ? 
1 1 1    6    2    9 o 95.79997 0.9731073   172.5150   265.3   91.78019 1.864473          ?        ? 
1 1 1    6    2   10 o 194.0543 1.541928   219.1270   248.3   376.6235 5.984357          ?        ? 
1 1 1    6    2   11 o 219.5693 1.705148   297.3393   105.5   482.2369 7.487964          ?        ? 
1 1 1    6    2   12 o 281.0848 2.054132   286.7003   140.6   790.5065 11.54770          ?        ? 
1 1 1    6    2   13 o 189.8638 1.457170   226.9233   130.3   360.6252 5.533275          ?        ? 
1 1 1    6    2   14 o 95.89816 1.019148   120.8998   266.8   91.99069 1.954689          ?        ? 
1 1 1    6    2   15 o 80.03601 0.9769049   74.81709    76.2   64.08374 1.563751          ?        ? 
1 1 1    6    2   16 o 43.89153 1.130492   55.60846   250.5   19.27625 0.9923807          ?        ? 
1 1 1    6    2   17 o 22.97901 2.028452   37.83249   260.8   5.292697 0.9322364          ?        ? 
1 1 1    6    2   18 o 65.09199 0.9932883   55.27748   259.3   42.40173 1.293102          ?        ? 
1 1 1    6    2   19 f 52.05389 1.357623   46.94243   158.6   27.15515 1.413391          ?        ? 
1 1 1    6    2   20 o 51.59314 1.369747   61.91711   151.9   26.70407 1.413391          ?        ? 
1 1 1    6    2   21 o 56.28092 1.255657   49.96154    42.8   31.81633 1.413391          ?        ? 
1 1 1    6    2   22 o 34.78014 2.334516   34.67894   149.5   12.35965 1.623896          ?        ? 
1 1 1    6    2   23 o 35.99537 3.341779   38.19425   147.7   13.86326 2.405771          ?        ? 
1 1 1    6    2   24 x        ?      ?   22.30813    59.4          ?        ?          ?        ? 
1 1 1    6    3    0 o 10.36311 1.286152   107.5993   180.0   1.082597 0.2706493   1.082597 0.2706493 
1 1 1    6    3    1 o 189.9573 1.408959   200.9773   228.9   360.8657 5.352841          ?        ? 
1 1 1    6    3    2 o 247.7769 1.699150   228.0516   212.8   614.0131 8.420200          ?        ? 
1 1 1    6    3    3 o 170.6498 1.365716   213.0640    48.5   291.2487 4.661182          ?        ? 
1 1 1    6    3    4 o 89.98894 0.7518961   6.728552   123.6   80.98428 1.353247          ?        ? 
1 1 1    6    3    5 o 349.4924 2.400661   427.4022   167.4   1222.042 16.78026          ?        ? 
1 1 1    6    3    6 o 205.3100 1.435425   300.0544   245.7   421.5814 5.894140          ?        ? 
1 1 1    6    3    7 o 42.15720 0.6776668   104.8857   278.5   17.77264 0.5713707          ?        ? 
1 1 1    6    3    8 o 441.6801 3.012797   558.6168    73.5   1951.442 26.61385          ?        ? 
1 1 1    6    3    9 o 276.4977 2.202409   292.1530   303.2   764.6745 12.17922          ?        ? 
1 1 1    6    3   10 o 190.9697 1.527467   240.8179   341.7   364.7451 5.833996          ?        ? 
1 1 1    6    3   11 o 281.7732 2.107812   328.7853   218.1   794.2956 11.87850          ?        ? 
1 1 1    6    3   12 o 162.4238 1.407111   175.1718   174.2   263.8831 4.570966          ?        ? 
1 1 1    6    3   13 o 185.5003 1.580609   214.9646   235.0   344.2659 5.864068          ?        ? 
1 1 1    6    3   14 o 126.3834 1.296794   151.2644   188.7   159.8034 3.277864          ?        ? 
1 1 1    6    3   15 o 52.64339 1.056799   63.50802   276.1   27.72652 1.112669          ?        ? 
1 1 1    6    3   16 o 161.6109 1.544443   170.3487   210.7   261.4773 4.991976          ?        ? 
1 1 1    6    3   17 o 66.71524 1.036734   50.35636    97.8   44.53685 1.383319          ?        ? 
1 1 1    6    3   18 o 102.0298 1.105271   97.06682   225.8   104.2000 2.255411          ?        ? 
1 1 1    6    3   19 o 76.36185 1.299577   77.26749    14.7   58.43018 1.984761          ?        ? 
1 1 1    6    3   20 o 23.25648 2.586131   22.89767   301.6   5.473131 1.202886          ?        ? 
1 1 1    6    3   21 o 47.95645 1.693094   54.92439     2.8   23.18562 1.623896          ?        ? 
1 1 1    6    3   22 o 28.36171 2.438709   31.79546   174.7   8.239767 1.383319          ?        ? 
1 1 1    6    3   23 o 32.20224 4.155643   36.52792    93.3   11.48756 2.676421          ?        ? 
1 1 1    6    3   24 o 22.13020 5.124639   31.39936   111.3   6.194862 2.225339          ?        ? 
1 1 1    6    4    0 f 537.8770 6.515539   494.1021   180.0   2896.850 70.06810   2896.850 70.06810 
1 1 1    6    4    1 o 176.5995 1.626217   145.9274    41.1   311.9083 5.743780          ?        ? 
1 1 1    6    4    2 o 447.0952 3.057020   410.9444    47.9   1999.888 27.33558          ?        ? 
1 1 1    6    4    3 o 260.3894 2.090353   402.8078   337.6   678.2471 10.88612          ?        ? 
1 1 1    6    4    4 o 61.60326 0.6346058   276.5325   233.7   37.95105 0.7818757          ?        ? 
1 1 1    6    4    5 f 158.9634 1.267483   121.3381   239.0   252.7263 4.029667          ?        ? 
1 1 1    6    4    6 f 396.7573 2.679347   434.7520   213.1   1574.908 21.26101          ?        ? 
1 1 1    6    4    7 o 211.6533 1.577111   149.9529   309.5   448.0148 6.676016          ?        ? 
1 1 1    6    4    8 o 394.9636 2.714356   541.8871   214.9   1560.383 21.44144          ?        ? 
1 1 1    6    4    9 o 237.9926 1.926952   383.5630   200.9   566.4991 9.172004          ?        ? 
1 1 1    6    4   10 f 176.7325 1.548423   160.3313   179.2   312.3895 5.473131          ?        ? 
1 1 1    6    4   11 o 193.7440 1.513355   182.2230   124.5   375.4507 5.864068          ?        ? 
1 1 1    6    4   12 o 88.94363 0.9635947   75.68944   226.1   79.11981 1.714112          ?        ? 
1 1 1    6    4   13 o 92.84240 1.085083   76.71825    63.4   86.21684 2.014834          ?        ? 
1 1 1    6    4   14 o 71.50848 1.093403   56.91280   205.0   51.15272 1.563751          ?        ? 
1 1 1    6    4   15 o 60.20810 1.048887   99.45811   348.0   36.26701 1.263030          ?        ? 
1 1 1    6    4   16 o 60.85016 1.087240   59.98653   355.0   37.04888 1.323174          ?        ? 
1 1 1    6    4   17 o 79.74185 1.093644   105.5375   142.0   63.63266 1.744184          ?        ? 
1 1 1    6    4   18 o 73.72539 1.325656   86.86446   282.5   54.43058 1.954689          ?        ? 
1 1 1    6    4   19 o 90.58439 1.145329   109.5742    14.7   82.18716 2.074978          ?        ? 
1 1 1    6    4   20 o 47.68053 1.450612   34.75138    13.5   22.82476 1.383319          ?        ? 
1 1 1    6    4   21 o 28.03596 2.198886   25.26605   342.2   7.969118 1.232958          ?        ? 
1 1 1    6    4   22 f 26.12020 2.302597   33.19280    27.9   6.976738 1.202886          ?        ? 
1 1 1    6    4   23 o 38.22506 2.163460   40.61056   344.5   15.03607 1.653968          ?        ? 
1 1 1    6    4   24 o 48.49244 2.170493   45.84505   159.8   24.50880 2.105050          ?        ? 
1 1 1    6    5    0 o 368.2369 4.717902   506.3477   180.0   1357.336 34.73333   1357.336 34.73333 
1 1 1    6    5    1 o 361.5361 3.235656   273.8196   219.8   1307.747 23.39613          ?        ? 
1 1 1    6    5    2 f 399.0553 3.074620   440.4014    48.1   1593.373 24.53887          ?        ? 
1 1 1    6    5    3 f 134.1273 1.154661   81.12383   249.2   179.9216 3.097431          ?        ? 
1 1 1    6    5    4 o 251.8935 1.850457   412.7687   352.6   634.7027 9.322365          ?        ? 
1 1 1    6    5    5 o 249.5500 1.662976   400.9471     0.5   622.8843 8.299912          ?        ? 
1 1 1    6    5    6 o 115.8593 0.9992960   155.2515   195.4   134.2421 2.315555          ?        ? 
1 1 1    6    5    7 o 74.52650 0.7868434   110.9614   239.5   55.54325 1.172814          ?        ? 
1 1 1    6    5    8 o 420.4762 2.900105   663.2422    27.4   1768.573 24.38851          ?        ? 
1 1 1    6    5    9 o 362.2084 2.760562   477.8229   163.1   1312.409 19.99798          ?        ? 
1 1 1    6    5   10 o 41.07231 1.025046   74.40809    79.7   16.87047 0.8420200          ?        ? 
1 1 1    6    5   11 o 368.0648 2.843278   407.2249    50.6   1355.803 20.93021          ?        ? 
1 1 1    6    5   12 o 42.65116 0.9518474   26.15896   342.8   18.19365 0.8119479          ?        ? 
1 1 1    6    5   13 o 105.1277 1.087003   109.5434   317.4   110.5452 2.285483          ?        ? 
1 1 1    6    5   14 o 137.3599 1.204113   170.9438    42.8   188.7629 3.307936          ?        ? 
1 1 1    6    5   15 o 109.8422 1.067726   127.0153   150.4   120.7096 2.345627          ?        ? 
1 1 1    6    5   16 o 40.42982 1.264479   41.24735   113.9   16.35925 1.022453          ?        ? 
1 1 1    6    5   17 o 39.52028 1.407719   30.53079   103.0   15.63752 1.112669          ?        ? 
1 1 1    6    5   18 o 85.89854 1.085276   90.75780   318.0   73.85719 1.864473          ?        ? 
1 1 1    6    5   19 o 64.14455 1.289250   73.18057    35.9   41.22891 1.653968          ?        ? 
1 1 1    6    5   20 o 42.53693 1.378583   45.88018    36.9   18.16358 1.172814          ?        ? 
1 1 1    6    5   21 o 52.29945 1.437498   51.82292   146.2   27.51601 1.503607          ?        ? 
1 1 1    6    5   22 o 55.10829 1.418799   44.69973   235.6   30.64352 1.563751          ?        ? 
1 1 1    6    5   23 o 16.12063 4.614195   15.37721    30.9   3.037287 1.563751          ?        ? 
1 1 1    6    5   24 o 20.06367 3.736559   22.06375   170.1   4.631110 1.443463          ?        ? 
1 1 1    6    6    0 o 689.3413 8.212739   1008.982   180.0   4762.917 113.1916   4762.917 113.1916 
1 1 1    6    6    1 o 361.5317 2.894658   258.0684   126.2   1307.717 20.93021          ?        ? 
1 1 1    6    6    2 o 202.3426 1.768577   296.7347   148.0   409.5225 7.157170          ?        ? 
1 1 1    6    6    3 o 196.9456 1.542196   335.3053   211.3   387.9607 6.074574          ?        ? 
1 1 1    6    6    4 o 51.67513 0.6110435   45.78490   271.6   26.70407 0.6315150          ?        ? 
1 1 1    6    6    5 o 303.2803 1.997999   381.3927   276.0   920.0573 12.11907          ?        ? 
1 1 1    6    6    6 o 169.9808 1.344554   273.2185   347.7   288.9633 4.570966          ?        ? 
1 1 1    6    6    7 o 276.5517 2.000811   331.4218   248.1   764.9151 11.06655          ?        ? 
1 1 1    6    6    8 o 211.3678 1.629037   281.8168   252.4   446.8120 6.886521          ?        ? 
1 1 1    6    6    9 o 528.3700 3.568567   603.1019    54.6   2793.462 37.71047          ?        ? 
1 1 1    6    6   10 o 260.8729 2.074951   320.4828    31.3   680.7431 10.82597          ?        ? 
1 1 1    6    6   11 o 198.7968 1.777431   207.9670   339.6   395.3284 7.066954          ?        ? 
1 1 1    6    6   12 o 49.83516 1.025835   73.37645   295.8   24.83959 1.022453          ?        ? 
1 1 1    6    6   13 o 57.84756 0.9617254   78.49101   248.5   33.47030 1.112669          ?        ? 
1 1 1    6    6   14 o 155.1464 1.356815   167.1582     8.8   240.8478 4.210100          ?        ? 
1 1 1    6    6   15 o 107.3253 1.036726   137.3188    57.4   115.2365 2.225339          ?        ? 
1 1 1    6    6   16 o 80.04978 0.9767369   75.54849   291.4   64.11382 1.563751          ?        ? 
1 1 1    6    6   17 o 78.90664 1.086165   93.44459   209.9   62.30948 1.714112          ?        ? 
1 1 1    6    6   18 o 91.52937 1.149932   70.78712   120.6   83.87121 2.105050          ?        ? 
1 1 1    6    6   19 o 85.87773 1.243118   91.04569   151.1   73.88726 2.135122          ?        ? 
1 1 1    6    6   20 o 43.81163 1.647351   50.12394   100.6   19.30632 1.443463          ?        ? 
1 1 1    6    6   21 o 28.99872 2.022182   41.26145   146.7   8.510417 1.172814          ?        ? 
1 1 1    6    6   22 o 36.03188 2.128226   38.68308   236.9   13.26182 1.533679          ?        ? 
1 1 1    6    6   23 o 35.30678 1.916412   31.95366   320.3   12.75059 1.353247          ?        ? 
1 1 1    6    6   24 o 31.86306 2.784190   28.85065   250.7   10.88612 1.774257          ?        ? 
1 1 1    6    7    0 o 33.19246 1.272459   189.3680   180.0   11.06655 0.8420200   11.06655 0.8420200 
1 1 1    6    7    1 f 256.5617 2.209449   117.2307   328.6   658.4897 11.33720          ?        ? 
1 1 1    6    7    2 o 305.1181 2.261930   195.4949   215.2   931.3945 13.80311          ?        ? 
1 1 1    6    7    3 o 56.45810 0.6658067   243.8125    71.4   31.87647 0.7518036          ?        ? 
1 1 1    6    7    4 o 213.8594 1.631150   169.1789   185.5   457.4575 6.976738          ?        ? 
1 1 1    6    7    5 o 291.8478 2.071114   516.9867   194.9   852.0040 12.08900          ?        ? 
1 1 1    6    7    6 o 448.4693 2.796197   578.2139   100.2   2011.977 25.08017          ?        ? 
1 1 1    6    7    7 f 437.6310 3.013186   493.3116   218.5   1915.806 26.37327          ?        ? 
1 1 1    6    7    8 o 115.2876 1.069463   112.2653   261.3   132.9189 2.465916          ?        ? 
1 1 1    6    7    9 o 348.5064 2.450598   360.3513    51.0   1214.945 17.08098          ?        ? 
1 1 1    6    7   10 o 53.56016 0.9544902   122.5478   160.2   28.68883 1.022453          ?        ? 
1 1 1    6    7   11 o 142.1542 1.322162   127.5072   329.5   202.1149 3.759018          ?        ? 
1 1 1    6    7   12 f 39.84267 1.169897   44.68274    21.8   15.87809 0.9322364          ?        ? 
1 1 1    6    7   13 o 172.9022 1.556635   168.5376    16.9   299.1276 5.382914          ?        ? 
1 1 1    6    7   14 o 159.4609 1.404968   209.4646   254.6   254.4404 4.480750          ?        ? 
1 1 1    6    7   15 o 104.2989 1.052392   134.9209   293.9   108.8311 2.195267          ?        ? 
1 1 1    6    7   16 o 87.61312 0.9782280   106.0766   101.6   76.80425 1.714112          ?        ? 
1 1 1    6    7   17 o 126.9601 1.184315   129.2657   254.2   161.3371 3.007215          ?        ? 
1 1 1    6    7   18 o 83.87689 1.093508   88.25003    75.4   70.42896 1.834401          ?        ? 
1 1 1    6    7   19 o 47.87499 1.413313   47.86336   208.1   22.97512 1.353247          ?        ? 
1 1 1    6    7   20 o 38.22115 1.730945   46.22177   130.0   14.70528 1.323174          ?        ? 
1 1 1    6    7   21 o 83.77026 1.274392   78.13842   136.9   70.51918 2.135122          ?        ? 
1 1 1    6    7   22 o 12.50898 4.186158   15.21148   310.4   1.653968 1.232958          ?        ? 
1 1 1    6    7   23 o 32.84707 2.014144   36.19547   246.0   11.06655 1.323174          ?        ? 
1 1 1    6    7   24 o 10.71448 4.308113   13.82143    47.9  0.9923807 1.413391          ?        ? 
1 1 1    6    8    0 o 110.7569 1.534718   459.4237    -0.0   122.7545 3.398152   122.7545 3.398152 
1 1 1    6    8    1 o 285.3501 2.429167   353.6330   287.4   814.6845 13.86326          ?        ? 
1 1 1    6    8    2 o 122.3073 1.143313   297.8693   152.5   149.6089 2.796710          ?        ? 
1 1 1    6    8    3 o 100.8294 0.9693055   173.0702   237.0   101.6739 1.954689          ?        ? 
1 1 1    6    8    4 o 153.4295 1.273998   211.2096   151.4   235.4348 3.909379          ?        ? 
1 1 1    6    8    5 o 175.8051 1.385537   238.5467     9.2   309.1116 4.871688          ?        ? 
1 1 1    6    8    6 o 169.7351 1.364217   214.1869   114.2   288.1212 4.631110          ?        ? 
1 1 1    6    8    7 o 303.5865 2.377351   347.4133   123.2   921.8315 14.43463          ?        ? 
1 1 1    6    8    8 o 193.6857 1.529337   206.2724    58.9   375.1801 5.924213          ?        ? 
1 1 1    6    8    9 o 58.60113 0.8723834   23.59065   198.1   34.34239 1.022453          ?        ? 
1 1 1    6    8   10 o 104.5766 1.035219   112.6092   248.6   109.3724 2.165194          ?        ? 
1 1 1    6    8   11 o 97.24482 1.051422   72.32950   157.2   94.57690 2.044906          ?        ? 
1 1 1    6    8   12 o 185.6783 1.465723   204.0524    15.0   344.8974 5.443058          ?        ? 
1 1 1    6    8   13 o 151.5462 1.428735   192.8811    46.2   229.7813 4.330389          ?        ? 
1 1 1    6    8   14 o 92.75440 1.086112   112.6385    23.2   86.06648 2.014834          ?        ? 
1 1 1    6    8   15 o 48.48198 1.054467   42.90602   224.1   23.51642 1.022453          ?        ? 
1 1 1    6    8   16 o 32.83610 1.465321   42.49080   257.4   10.79590 0.9623086          ?        ? 
1 1 1    6    8   17 o 18.06521 2.580198   21.30997     7.9   3.277864 0.9322364          ?        ? 
1 1 1    6    8   18 o 8.824527 3.552051   28.02426   165.3  0.3608657 0.9623086          ?        ? 
1 1 1    6    8   19 o 25.36213 2.015708   33.12504   315.4   6.465511 1.022453          ?        ? 
1 1 1    6    8   20 o 36.49842 2.018629   42.48886    19.2   13.44225 1.473535          ?        ? 
1 1 1    6    8   21 o 43.25950 1.981197   44.05463   174.6   18.94545 1.714112          ?        ? 
1 1 1    6    8   22 o 14.65726 4.659845   24.72586   233.8   2.405771 1.533679          ?        ? 
1 1 1    6    8   23 o 9.071222 3.936063   10.12850   184.2       0.06 1.323174          ?        ? 
1 1 1    6    8   24 o 24.16115 2.987157   23.99790   101.4   6.375295 1.443463          ?        ? 
1 1 1    6    9    0 o 71.82345 1.214994   302.3837     0.0   51.63387 1.744184   51.63387 1.744184 
1 1 1    6    9    1 o 426.1102 3.059367   365.5059   161.9   1817.260 26.07255          ?        ? 
1 1 1    6    9    2 o 244.4368 1.906907   238.7716   112.7   597.6839 9.322365          ?        ? 
1 1 1    6    9    3 o 66.66676 0.7668386   44.43916   350.9   44.44663 1.022453          ?        ? 
1 1 1    6    9    4 o 225.4869 1.733750   76.42950     9.7   508.5500 7.818758          ?        ? 
1 1 1    6    9    5 o 45.97836 0.7521575   32.30675   123.1   21.14072 0.6916593          ?        ? 
1 1 1    6    9    6 o 197.9259 1.549751   310.0215   294.1   391.7799 6.134717          ?        ? 
1 1 1    6    9    7 o 313.0894 2.434860   405.3769   359.6   980.4722 15.24658          ?        ? 
1 1 1    6    9    8 o 94.02506 1.119409   20.10338   141.1   88.41210 2.105050          ?        ? 
1 1 1    6    9    9 o 186.7431 1.497624   158.6739     3.9   348.7768 5.593419          ?        ? 
1 1 1    6    9   10 o 255.7928 1.916301   271.2466    92.7   654.5202 9.803518          ?        ? 
1 1 1    6    9   11 f 261.8636 1.958004   255.4896   208.9   686.0358 10.25460          ?        ? 
1 1 1    6    9   12 o 145.5534 1.249964   145.0043   232.0   211.9184 3.638730          ?        ? 
1 1 1    6    9   13 o 45.34738 1.027883   49.37659    54.9   20.56935 0.9322364          ?        ? 
1 1 1    6    9   14 o 43.34232 1.214200   48.17026   320.2   18.79509 1.052525          ?        ? 
1 1 1    6    9   15 o 166.5521 1.625013   184.2096    73.2   277.7463 5.412986          ?        ? 
1 1 1    6    9   16 o 167.7514 1.389313   182.9460   310.0   281.7159 4.661182          ?        ? 
1 1 1    6    9   17 o 22.90699 2.100469   31.09513    10.8   5.262625 0.9623086          ?        ? 
1 1 1    6    9   18 o 63.31817 1.187343   66.14272   297.0   40.14631 1.503607          ?        ? 
1 1 1    6    9   19 o 84.91528 1.115550   97.11591   259.7   72.23329 1.894545          ?        ? 
1 1 1    6    9   20 o 10.70247 3.945302   15.87327     7.2  0.9623086 1.112669          ?        ? 
1 1 1    6    9   21 o 58.33017 1.417764   61.19262   305.8   34.25217 1.653968          ?        ? 
1 1 1    6    9   22 o 14.64952 4.066726   18.35478   209.9   2.405771 1.232958          ?        ? 
1 1 1    6    9   23 f 21.69667 2.979956   8.050109    74.3   4.991976 1.293102          ?        ? 
1 1 1    6    9   24 o 16.72733 4.674862   18.17458   233.5   3.608657 1.623896          ?        ? 
1 1 1    6   10    0 o 435.8826 4.551095   171.6360     0.0   1902.244 39.66516   1902.244 39.66516 
1 1 1    6   10    1 o 42.40555 0.7446136   209.2490   185.1   17.98314 0.6315150          ?        ? 
1 1 1    6   10    2 o 130.9280 1.217329   157.9960   332.6   171.4413 3.187647          ?        ? 
1 1 1    6   10    3 o 96.23739 0.9374365   188.2896   158.5   92.62221 1.804329          ?        ? 
1 1 1    6   10    4 o 218.4332 1.693367   395.4660    97.1   477.2149 7.397748          ?        ? 
1 1 1    6   10    5 o 564.5958 3.802988   679.6517    49.9   3189.602 42.94302          ?        ? 
1 1 1    6   10    6 o 322.2614 2.351563   397.1224   212.5   1038.722 15.15636          ?        ? 
1 1 1    6   10    7 o 380.5960 2.662748   451.5471   122.4   1448.966 20.26863          ?        ? 
1 1 1    6   10    8 o 145.5365 1.384418   206.0066    44.7   211.8282 4.029667          ?        ? 
1 1 1    6   10    9 o 320.2837 2.539784   328.9131   229.9   1026.242 16.26903          ?        ? 
1 1 1    6   10   10 o 332.5215 2.387529   387.2189   152.5   1106.324 15.87809          ?        ? 
1 1 1    6   10   11 o 136.0246 1.215932   181.2715   162.5   185.0640 3.307936          ?        ? 
1 1 1    6   10   12 o 36.37090 1.157546   6.170519   255.5   13.23174 0.8420200          ?        ? 
1 1 1    6   10   13 o 54.58364 0.9916865   54.78008   336.0   29.80149 1.082597          ?        ? 
1 1 1    6   10   14 o 125.5547 1.185595   134.9835    31.9   157.7284 2.977142          ?        ? 
1 1 1    6   10   15 o 31.62626 1.568919   33.76464   188.6   10.01402 0.9923807          ?        ? 
1 1 1    6   10   16 o 71.93403 1.170545   70.01073   153.0   51.78423 1.684040          ?        ? 
1 1 1    6   10   17 o 7.969688 3.375980   22.55116   269.2       0.03 0.9322364          ?        ? 
1 1 1    6   10   18 o 20.37124 2.730982   19.80637   322.0   4.180028 1.112669          ?        ? 
1 1 1    6   10   19 o 55.39885 1.248508   49.50203   220.4   30.76381 1.383319          ?        ? 
1 1 1    6   10   20 o 14.13002 3.762714   21.06651   229.4   2.135122 1.082597          ?        ? 
1 1 1    6   10   21 o 24.36158 2.283656   26.89354    70.1   6.044501 1.112669          ?        ? 
1 1 1    6   10   22 o 8.677713 3.805217   10.60057    76.5 -0.1202886 1.263030          ?        ? 
1 1 1    6   10   23 o 30.08559 2.149039   24.43185   120.5   9.352437 1.293102          ?        ? 
1 1 1    6   10   24 f 13.32972 4.700071   18.38960   228.0   2.255411 1.563751          ?        ? 
1 1 1    6   11    0 o 84.03012 1.342792   434.4379    -0.0   70.66954 2.255411   70.66954 2.255411 
1 1 1    6   11    1 o 528.3669 3.437682   526.5225    96.5   2794.183 36.32715          ?        ? 
1 1 1    6   11    2 o 128.5079 1.064746   108.5561    82.5   165.1562 2.736565          ?        ? 
1 1 1    6   11    3 o 165.7419 1.415229   190.4149   157.4   274.7391 4.691255          ?        ? 
1 1 1    6   11    4 o 380.0171 2.690545   478.8097     1.1   1444.636 20.44906          ?        ? 
1 1 1    6   11    5 o 374.0404 2.633039   331.8115   351.8   1399.407 19.69725          ?        ? 
1 1 1    6   11    6 o 337.2067 2.430159   356.2282   175.7   1137.328 16.38932          ?        ? 
1 1 1    6   11    7 o 189.0183 1.551190   229.6963   181.4   357.3172 5.864068          ?        ? 
1 1 1    6   11    8 o 160.2643 1.463599   185.0041   224.4   256.8763 4.691255          ?        ? 
1 1 1    6   11    9 o 223.4738 1.830108   194.4827   115.8   499.5284 8.179624          ?        ? 
1 1 1    6   11   10 f 109.5718 1.221310   103.5272    68.3   120.0781 2.676421          ?        ? 
1 1 1    6   11   11 o 204.8217 1.593009   163.6446    51.5   419.6869 6.525656          ?        ? 
1 1 1    6   11   12 o 181.3824 1.450699   231.1017   305.1   329.1396 5.262625          ?        ? 
1 1 1    6   11   13 o 127.1927 1.182149   142.3026   270.5   161.8483 3.007215          ?        ? 
1 1 1    6   11   14 o 42.50041 1.167495   31.92098    60.3   18.07336 0.9923807          ?        ? 
1 1 1    6   11   15 o 43.02574 1.188188   53.94405   154.5   18.52444 1.022453          ?        ? 
1 1 1    6   11   16 o 27.29101 1.542670   48.30231    89.0   7.457891 0.8420200          ?        ? 
1 1 1    6   11   17 o 60.64587 1.041316   65.08916    26.0   36.80830 1.263030          ?        ? 
1 1 1    6   11   18 o 90.35291 1.081697   98.56770   165.3   81.73608 1.954689          ?        ? 
1 1 1    6   11   19 o 51.47666 1.168380   56.71311    47.9   26.55371 1.202886          ?        ? 
1 1 1    6   11   20 o 42.92416 1.471234   47.48558   232.0   18.52444 1.263030          ?        ? 
1 1 1    6   11   21 o 32.41314 1.901942   41.32020   113.1   10.64554 1.232958          ?        ? 
1 1 1    6   11   22 o 16.63165 3.866903   7.788178    73.6   3.097431 1.263030          ?        ? 
1 1 1    6   11   23 o 15.10612 4.634940   17.31520   326.6   2.736565 1.533679          ?        ? 
1 1 1    6   11   24 o 8.599559 3.951376   9.006558    18.1 -0.4811543 1.563751          ?        ? 
1 1 1    6   12    0 o 166.9796 1.792405   230.4581    -0.0   278.9492 5.984357   278.9492 5.984357 
1 1 1    6   12    1 o 112.9010 1.052117   136.6277   198.3   127.4758 2.375700          ?        ? 
1 1 1    6   12    2 o 276.8584 1.960577   278.6412   167.0   766.6893 10.85604          ?        ? 
1 1 1    6   12    3 o 153.9799 1.318269   167.7827    90.2   237.1189 4.059740          ?        ? 
1 1 1    6   12    4 o 239.7341 1.850234   278.2917    76.1   574.7990 8.871283          ?        ? 
1 1 1    6   12    5 o 206.5340 1.659884   200.0902    77.9   426.6034 6.856449          ?        ? 
1 1 1    6   12    6 o 385.7249 2.748184   563.6149   132.5   1488.301 21.20086          ?        ? 
1 1 1    6   12    7 o 716.9827 4.737421   749.8691   335.0   5145.916 67.93298          ?        ? 
1 1 1    6   12    8 o 176.5187 1.626961   222.2406   341.9   311.6377 5.743780          ?        ? 
1 1 1    6   12    9 o 310.3228 2.456568   346.0941    98.9   963.5115 15.24658          ?        ? 
1 1 1    6   12   10 o 173.3545 1.595942   138.8645    61.3   300.6012 5.533275          ?        ? 
1 1 1    6   12   11 o 80.21339 1.049725   98.02644    11.1   64.35439 1.684040          ?        ? 
1 1 1    6   12   12 o 82.52111 0.9839275   92.70816   213.7   68.11341 1.623896          ?        ? 
1 1 1    6   12   13 o 29.77431 1.464505   27.80901    98.9   8.871283 0.8720922          ?        ? 
1 1 1    6   12   14 o 38.61045 1.168290   80.80396   175.7   14.91578 0.9021643          ?        ? 
1 1 1    6   12   15 o 171.6001 1.463300   180.6485   314.3   294.7972 5.022048          ?        ? 
1 1 1    6   12   16 o 131.3453 1.236356   155.8715   313.4   172.6743 3.247792          ?        ? 
1 1 1    6   12   17 o 44.89022 1.306313   51.37843   349.1   20.17841 1.172814          ?        ? 
1 1 1    6   12   18 o 73.07798 1.008194   65.99625   197.5   53.46827 1.473535          ?        ? 
1 1 1    6   12   19 o 40.98512 1.247347   46.63420   208.5   16.84040 1.022453          ?        ? 
1 1 1    6   12   20 o 7.817862 3.316848   11.54805   242.6       0.06 0.9021643          ?        ? 
1 1 1    6   12   21 o 9.294900 3.691056   23.98262   153.9  0.5412986 1.022453          ?        ? 
1 1 1    6   12   22 o 21.54384 2.861510   10.01934   150.2   4.871688 1.232958          ?        ? 
1 1 1    6   12   23 o 14.81122 4.309765   14.70521   330.8   2.616277 1.353247          ?        ? 
1 1 1    6   12   24 o 35.54133 2.326823   30.69522   320.7   13.47232 1.653968          ?        ? 
1 1 1    6   13    0 o 160.6492 1.778808   272.2768     0.0   258.1994 5.713707   258.1994 5.713707 
1 1 1    6   13    1 o 311.5987 2.152155   346.0950    24.5   971.1799 13.41218          ?        ? 
1 1 1    6   13    2 o 131.9384 1.128232   136.3519   258.9   174.0876 2.977142          ?        ? 
1 1 1    6   13    3 o 169.7711 1.319644   74.38409   332.3   288.2415 4.480750          ?        ? 
1 1 1    6   13    4 o 361.7439 2.597845   493.9149   347.8   1308.890 18.79509          ?        ? 
1 1 1    6   13    5 o 128.4978 1.216948   57.82609   197.7   165.1261 3.127503          ?        ? 
1 1 1    6   13    6 o 80.03159 1.052110   101.6585   199.1   64.05367 1.684040          ?        ? 
1 1 1    6   13    7 o 368.8760 2.641368   400.2952   329.7   1361.186 19.48675          ?        ? 
1 1 1    6   13    8 o 88.21542 1.176086   171.2708   101.9   77.82671 2.074978          ?        ? 
1 1 1    6   13    9 o 281.0287 2.289957   290.1861    25.1   790.1757 12.87088          ?        ? 
1 1 1    6   13   10 o 69.40353 1.083236   87.72898   263.7   48.17558 1.503607          ?        ? 
1 1 1    6   13   11 o 71.93258 1.086956   65.92165   335.8   51.75416 1.563751          ?        ? 
1 1 1    6   13   12 o 87.86456 1.095218   92.29972     9.1   77.22527 1.924617          ?        ? 
1 1 1    6   13   13 f 71.95004 0.9822029   109.4908    18.8   51.78423 1.413391          ?        ? 
1 1 1    6   13   14 o 21.15245 1.848192   55.10538    31.5   4.480750 0.7818757          ?        ? 
1 1 1    6   13   15 o 41.01801 1.246347   67.05038   347.3   16.84040 1.022453          ?        ? 
1 1 1    6   13   16 o 53.48481 1.096399   55.29412   147.3   28.62868 1.172814          ?        ? 
1 1 1    6   13   17 o 130.5465 1.266957   135.8658    94.7   170.6594 3.307936          ?        ? 
1 1 1    6   13   18 o 86.42361 1.043887   87.87327   268.3   74.78942 1.804329          ?        ? 
1 1 1    6   13   19 o 26.67737 1.690879   37.61322   170.6   7.157170 0.9021643          ?        ? 
1 1 1    6   13   20 o 12.98121 3.424896   16.14296   326.3   1.804329 0.9021643          ?        ? 
1 1 1    6   13   21 o 12.49585 3.633756   26.82695   347.8   1.684040 0.9623086          ?        ? 
1 1 1    6   13   22 o 24.29116 2.166478   28.81193   120.7   6.074574 1.052525          ?        ? 
1 1 1    6   13   23 o 36.47924 1.648727   44.17687   130.2   13.62268 1.202886          ?        ? 
1 1 1    6   13   24 o 6.942980 3.255043   4.434845   241.1 -0.7818757 1.142741          ?        ? 
1 1 1    6   14    0 o 316.8003 3.000222   110.9006   180.0   1004.079 19.00560   1004.079 19.00560 
1 1 1    6   14    1 o 136.0678 1.149244   149.1425    10.3   185.1542 3.127503          ?        ? 
1 1 1    6   14    2 o 39.61986 0.7590170   156.8171     2.9   15.69766 0.6014429          ?        ? 
1 1 1    6   14    3 f 371.5315 2.452513   469.0676   253.9   1380.642 18.22372          ?        ? 
1 1 1    6   14    4 o 375.1240 2.485142   519.9850   199.8   1407.497 18.64473          ?        ? 
1 1 1    6   14    5 o 83.74079 1.005508   73.71792   187.2   70.12824 1.684040          ?        ? 
1 1 1    6   14    6 f 558.0465 3.791037   570.6967   296.5   3116.226 42.31151          ?        ? 
1 1 1    6   14    7 o 169.0742 1.440695   150.4457   118.1   285.8959 4.871688          ?        ? 
1 1 1    6   14    8 o 233.4273 1.816485   250.5595    11.6   545.0276 8.480345          ?        ? 
1 1 1    6   14    9 o 214.9305 1.874870   180.1849   123.1   462.1186 8.059335          ?        ? 
1 1 1    6   14   10 o 54.53030 1.130526   78.90879   316.0   29.74135 1.232958          ?        ? 
1 1 1    6   14   11 o 155.6523 1.497306   178.8141   151.0   242.3815 4.661182          ?        ? 
1 1 1    6   14   12 o 165.4516 1.590383   169.1734    89.2   273.9272 5.262625          ?        ? 
1 1 1    6   14   13 o 45.47425 1.157276   76.91920   259.7   20.68964 1.052525          ?        ? 
1 1 1    6   14   14 o 50.81120 1.065313   67.89395   104.9   25.83197 1.082597          ?        ? 
1 1 1    6   14   15 o 123.7782 1.202611   109.2457    76.5   153.3379 2.977142          ?        ? 
1 1 1    6   14   16 o 22.64087 2.191569   10.51668   107.9   5.142337 0.9923807          ?        ? 
1 1 1    6   14   17 o 57.76749 1.119230   53.47717   264.6   33.41015 1.293102          ?        ? 
1 1 1    6   14   18 o 37.22564 1.454101   45.07269   108.4   13.89333 1.082597          ?        ? 
1 1 1    6   14   19 o 35.72055 1.346996   16.33900   124.8   12.81073 0.9623086          ?        ? 
1 1 1    6   14   20 o 17.92563 2.600290   22.06561   255.7   3.277864 0.9322364          ?        ? 
1 1 1    6   14   21 o 29.64066 1.674020   41.99392   344.5   8.901355 0.9923807          ?        ? 
1 1 1    6   14   22 f 7.718035 3.352911   14.36221   322.6      -0.03 0.9623086          ?        ? 
1 1 1    6   14   23 o 11.30317 3.867745   16.43723   251.7   1.413391 1.052525          ?        ? 
1 1 1    6   15    0 o 177.0080 1.869274   230.6281     0.0   313.4420 6.615872   313.4420 6.615872 
1 1 1    6   15    1 o 253.3664 1.715076   405.2672   269.6   642.0102 8.690849          ?        ? 
1 1 1    6   15    2 o 483.4538 3.153679   464.0521   125.6   2338.079 30.49315          ?        ? 
1 1 1    6   15    3 o 187.5437 1.451144   295.5970    21.0   351.7539 5.443058          ?        ? 
1 1 1    6   15    4 o 122.5817 1.103955   73.08841   266.1   150.2705 2.706493          ?        ? 
1 1 1    6   15    5 o 141.8558 1.165951   138.7090   315.2   201.2428 3.307936          ?        ? 
1 1 1    6   15    6 o 163.9282 1.449232   210.7093   336.3   268.7548 4.751399          ?        ? 
1 1 1    6   15    7 o 297.7209 2.267626   270.7227   250.1   886.6772 13.50239          ?        ? 
1 1 1    6   15    8 o 145.6867 1.279782   172.8936    83.1   212.2793 3.728946          ?        ? 
1 1 1    6   15    9 o 113.7049 1.229811   119.1140     7.4   129.3102 2.796710          ?        ? 
1 1 1    6   15   10 o 182.8626 1.669189   206.6633   155.3   334.5526 6.104645          ?        ? 
1 1 1    6   15   11 o 214.6297 1.863487   252.8855   270.8   461.0360 7.999191          ?        ? 
1 1 1    6   15   12 o 93.60658 1.172603   125.8698   168.4   87.66030 2.195267          ?        ? 
1 1 1    6   15   13 o 116.9976 1.272309   118.5257    92.0   136.9786 2.977142          ?        ? 
1 1 1    6   15   14 o 91.17825 1.071906   101.8019   293.1   83.17956 1.954689          ?        ? 
1 1 1    6   15   15 o 244.8711 1.946508   269.4511   203.3   600.8715 9.532870          ?        ? 
1 1 1    6   15   16 o 66.27956 1.088920   92.89596   164.2   43.96547 1.443463          ?        ? 
1 1 1    6   15   17 o 82.20760 1.115713   99.61959   235.0   67.66232 1.834401          ?        ? 
1 1 1    6   15   18 o 49.74501 1.329957   46.96995   113.9   24.80952 1.323174          ?        ? 
1 1 1    6   15   19 o 59.94957 1.203898   51.40376   256.6   36.05650 1.443463          ?        ? 
1 1 1    6   15   20 o 18.54508 2.675591   23.69674   245.2   3.518441 0.9923807          ?        ? 
1 1 1    6   15   21 o 55.08177 1.173802   57.16118   231.6   30.55330 1.293102          ?        ? 
1 1 1    6   15   22 o 9.342254 3.696977   16.03486   137.8  0.6315150 1.022453          ?        ? 
1 1 1    6   15   23 f 14.05634 3.695066   5.250444   209.4   2.315555 1.052525          ?        ? 
1 1 1    6   16    0 o 289.3127 2.744661   381.1925     0.0   837.3589 15.87809   837.3589 15.87809 
1 1 1    6   16    1 o 510.8617 3.128703   559.0474    11.5   2610.743 31.96669          ?        ? 
1 1 1    6   16    2 f 486.7550 3.194071   478.7246   265.5   2370.256 31.09460          ?        ? 
1 1 1    6   16    3 o 265.2450 1.899031   342.2534   205.5   703.6581 10.07417          ?        ? 
1 1 1    6   16    4 o 157.8098 1.276748   332.9615   112.1   249.0575 4.029667          ?        ? 
1 1 1    6   16    5 o 101.0247 0.9823151   114.7990   266.1   102.0649 1.984761          ?        ? 
1 1 1    6   16    6 o 179.8792 1.446104   154.1330   178.9   323.6064 5.202481          ?        ? 
1 1 1    6   16    7 o 150.0177 1.413225   168.7626   183.1   225.0900 4.240172          ?        ? 
1 1 1    6   16    8 f 141.8049 1.325419   150.4103   230.3   201.1225 3.759018          ?        ? 
1 1 1    6   16    9 o 84.16445 1.161232   103.2181   251.2   70.84998 1.954689          ?        ? 
1 1 1    6   16   10 o 218.9025 1.895801   219.7758   163.6   479.5003 8.299912          ?        ? 
1 1 1    6   16   11 o 152.9846 1.474273   158.1758   148.7   234.1718 4.510822          ?        ? 
1 1 1    6   16   12 o 219.1977 1.900108   245.2515    18.1   481.0340 8.329985          ?        ? 
1 1 1    6   16   13 o 121.7558 1.309034   134.9739   101.2   148.3459 3.187647          ?        ? 
1 1 1    6   16   14 o 16.03634 3.207507   25.44294   314.8   2.676421 0.9923807          ?        ? 
1 1 1    6   16   15 o 19.43874 2.165830   36.39641    16.2   3.789090 0.8420200          ?        ? 
1 1 1    6   16   16 o 10.69367 3.746801   6.481156   272.4   1.022453 0.9923807          ?        ? 
1 1 1    6   16   17 o 32.99260 1.640666   35.92684   340.5   10.91619 1.082597          ?        ? 
1 1 1    6   16   18 o 23.12463 2.080701   18.60974     0.9   5.382914 0.9623086          ?        ? 
1 1 1    6   16   19 o 51.06497 1.177799   56.55574   347.4   26.16277 1.202886          ?        ? 
1 1 1    6   16   20 o 38.83587 1.393811   39.74807   155.4   15.18643 1.082597          ?        ? 
1 1 1    6   16   21 o 9.114589 3.631038   9.186939    37.6  0.5412986 0.9923807          ?        ? 
1 1 1    6   16   22 o 15.68283 3.357127   16.63893   342.1   2.736565 1.022453          ?        ? 
1 1 1    6   16   23 o 26.30240 2.172314   24.93524   199.4   7.277459 1.142741          ?        ? 
1 1 1    6   17    0 o 302.4008 2.919312   374.2914     0.0   914.8849 17.65235   914.8849 17.65235 
1 1 1    6   17    1 o 189.8459 1.386025   194.0139   275.6   360.4447 5.262625          ?        ? 
1 1 1    6   17    2 o 151.8975 1.217556   124.9154   243.2   230.7436 3.698874          ?        ? 
1 1 1    6   17    3 o 406.2416 2.716728   464.9209   296.0   1650.871 22.07295          ?        ? 
1 1 1    6   17    4 o 191.3346 1.453826   201.0470   341.0   366.1284 5.563347          ?        ? 
1 1 1    6   17    5 o 314.9916 2.157615   296.3478   220.6   992.4710 13.59261          ?        ? 
1 1 1    6   17    6 o 301.1263 2.117150   355.4493    19.6   907.0661 12.75059          ?        ? 
1 1 1    6   17    7 o 237.5102 1.721952   226.6806   109.7   564.2737 8.179624          ?        ? 
1 1 1    6   17    8 o 292.0915 2.234113   317.8344   341.1   853.6580 13.05131          ?        ? 
1 1 1    6   17    9 f 143.0369 1.461171   199.8394   228.2   204.6710 4.180028          ?        ? 
1 1 1    6   17   10 o 44.47272 1.487625   27.02629   152.9   19.78747 1.323174          ?        ? 
1 1 1    6   17   11 o 99.67208 1.252100   92.10114   183.3   99.38844 2.495988          ?        ? 
1 1 1    6   17   12 o 20.86078 2.306502   37.40150   283.3   4.360461 0.9623086          ?        ? 
1 1 1    6   17   13 o 168.1480 1.645359   221.3777   170.4   283.0992 5.533275          ?        ? 
1 1 1    6   17   14 o 42.59464 1.376715   25.25611    63.9   18.16358 1.172814          ?        ? 
1 1 1    6   17   15 o 37.44928 1.445418   53.18599   346.7   14.04369 1.082597          ?        ? 
1 1 1    6   17   16 o 27.64949 1.903335   32.33437   138.7   7.668397 1.052525          ?        ? 
1 1 1    6   17   17 o 31.68628 1.660853   42.80637   306.1   10.07417 1.052525          ?        ? 
1 1 1    6   17   18 o 47.68583 1.198198   47.96814    69.4   22.79469 1.142741          ?        ? 
1 1 1    6   17   19 o 59.99973 1.227952   62.99340    88.4   36.14672 1.473535          ?        ? 
1 1 1    6   17   20 o 10.54910 3.637645   10.35030    64.4   1.082597 0.9322364          ?        ? 
1 1 1    6   17   21 o 9.318444 3.694000   3.073528   123.7  0.6014429 1.022453          ?        ? 
1 1 1    6   17   22 o 26.55462 2.038434   28.26039   194.5   7.277459 1.082597          ?        ? 
1 1 1    6   17   23 o 35.30280 1.661078   32.38173     5.1   12.87088 1.172814          ?        ? 
1 1 1    6   18    0 o 421.6043 3.766788   342.8482   180.0   1778.497 31.75618   1778.497 31.75618 
1 1 1    6   18    1 o 394.5305 2.496290   396.5114   120.5   1556.985 19.69725          ?        ? 
1 1 1    6   18    2 f 63.07460 0.8581879   87.67942   169.3   39.78545 1.082597          ?        ? 
1 1 1    6   18    3 o 19.54106 1.769759   66.48159   191.3   3.819162 0.6916593          ?        ? 
1 1 1    6   18    4 o 493.8722 3.211976   534.6255   348.3   2440.595 31.72611          ?        ? 
1 1 1    6   18    5 o 105.7208 1.095128   142.9636   162.0   111.7782 2.315555          ?        ? 
1 1 1    6   18    6 o 90.23736 0.9997681   52.09098     8.5   81.43536 1.804329          ?        ? 
1 1 1    6   18    7 o 133.2922 1.229578   94.55517    44.9   177.6963 3.277864          ?        ? 
1 1 1    6   18    8 o 35.27991 1.321200   41.10245   219.8   12.44987 0.9322364          ?        ? 
1 1 1    6   18    9 o 112.5966 1.215208   137.6909    84.6   126.8142 2.736565          ?        ? 
1 1 1    6   18   10 o 106.2849 1.273226   117.7960    59.6   113.0111 2.706493          ?        ? 
1 1 1    6   18   11 o 87.04871 1.226395   95.16489   232.1   75.81188 2.135122          ?        ? 
1 1 1    6   18   12 o 90.24532 1.249600   84.65369   183.7   81.49551 2.255411          ?        ? 
1 1 1    6   18   13 f 67.27382 1.206930   65.24662   356.1   45.28865 1.623896          ?        ? 
1 1 1    6   18   14 o 41.59263 1.518334   50.42722   242.3   17.32155 1.263030          ?        ? 
1 1 1    6   18   15 o 70.61945 1.213626   54.25081    50.6   49.91976 1.714112          ?        ? 
1 1 1    6   18   16 o 11.50241 3.755615   21.79929   106.2   1.293102 0.9923807          ?        ? 
1 1 1    6   18   17 o 26.75348 1.854676   45.38004   137.6   7.187243 0.9923807          ?        ? 
1 1 1    6   18   18 o 76.09923 1.126235   74.80564     2.2   58.06931 1.714112          ?        ? 
1 1 1    6   18   19 o 43.04599 1.467071   48.83783   275.5   18.64473 1.263030          ?        ? 
1 1 1    6   18   20 o 19.19112 2.663871   19.90807   207.2   3.789090 1.022453          ?        ? 
1 1 1    6   18   21 f 25.38085 2.073463   27.19416   160.6   6.615872 1.052525          ?        ? 
1 1 1    6   18   22 o 19.67147 2.751694   21.12996   320.8   4.119884 1.082597          ?        ? 
1 1 1    6   18   23 o 8.721685 3.634824   8.922250   227.0  0.4811543 1.052525          ?        ? 
1 1 1    6   19    0 o 587.7349 4.948557   548.9332   180.0   3457.334 58.15953   3457.334 58.15953 
1 1 1    6   19    1 o 542.3571 3.251975   492.9383   139.3   2943.221 35.27463          ?        ? 
1 1 1    6   19    2 o 133.0498 1.096206   155.0043   156.6   177.0347 2.916998          ?        ? 
1 1 1    6   19    3 o 172.7511 1.410031   183.6728   260.3   298.4660 4.871688          ?        ? 
1 1 1    6   19    4 o 433.0000 2.837060   474.0161   247.2   1875.961 24.56894          ?        ? 
1 1 1    6   19    5 o 365.7304 2.524304   356.6009    74.4   1338.361 18.46430          ?        ? 
1 1 1    6   19    6 o 100.2751 1.004653   100.8494   135.8   100.5612 2.014834          ?        ? 
1 1 1    6   19    7 o 149.6736 1.275830   211.9001    58.9   224.0675 3.819162          ?        ? 
1 1 1    6   19    8 o 86.19521 0.9594315   109.9081   218.5   74.30827 1.653968          ?        ? 
1 1 1    6   19    9 o 56.02536 1.019843   44.84581   134.4   31.39532 1.142741          ?        ? 
1 1 1    6   19   10 o 116.5960 1.392755   98.84688   299.1   136.0163 3.247792          ?        ? 
1 1 1    6   19   11 o 50.72108 1.334008   51.45079    20.0   25.74175 1.353247          ?        ? 
1 1 1    6   19   12 o 74.24185 1.215169   91.41428   331.8   55.15231 1.804329          ?        ? 
1 1 1    6   19   13 o 96.45003 1.231570   87.66705   282.9   93.10336 2.375700          ?        ? 
1 1 1    6   19   14 o 54.47916 1.352384   46.07610   203.4   29.71128 1.473535          ?        ? 
1 1 1    6   19   15 o 37.91515 1.665601   60.03849   107.4   14.40456 1.263030          ?        ? 
1 1 1    6   19   16 o 9.585513 3.865624   22.76285   146.9  0.4210100 1.142741          ?        ? 
1 1 1    6   19   17 o 31.34797 1.582847   25.38722   163.7   9.863664 0.9923807          ?        ? 
1 1 1    6   19   18 o 80.91058 1.115014   84.00087   204.6   65.64749 1.804329          ?        ? 
1 1 1    6   19   19 o 31.49247 1.766564   21.50656   331.3   10.01402 1.112669          ?        ? 
1 1 1    6   19   20 o 38.10413 1.617880   40.04760    88.7   14.70528 1.232958          ?        ? 
1 1 1    6   19   21 o 28.15629 1.975881   27.99713    40.3   8.119479 1.112669          ?        ? 
1 1 1    6   19   22 o 9.426850 3.874263   11.37848   124.2  0.5713707 1.172814          ?        ? 
1 1 1    6   19   23 o 12.94514 3.878694   13.47465    78.3   2.074978 1.082597          ?        ? 
1 1 1    6   20    0 o 504.1011 4.322718   518.7666    -0.0   2543.231 43.57454   2543.231 43.57454 
1 1 1    6   20    1 o 270.6553 1.877736   258.5291   190.2   732.7078 10.16438          ?        ? 
1 1 1    6   20    2 o 70.43867 0.9392386   29.33406   297.8   49.61904 1.323174          ?        ? 
1 1 1    6   20    3 o 209.4642 1.622307   187.8003    17.6   438.8428 6.796305          ?        ? 
1 1 1    6   20    4 o 165.2573 1.337491   183.4975    20.9   273.1453 4.420605          ?        ? 
1 1 1    6   20    5 o 214.0301 1.608774   188.0637   319.6   458.2093 6.886521          ?        ? 
1 1 1    6   20    6 o 259.6424 1.905262   279.4324   277.7   674.4280 9.893736          ?        ? 
1 1 1    6   20    7 o 137.4828 1.246783   191.3881   246.4   189.0636 3.428224          ?        ? 
1 1 1    6   20    8 o 210.4281 1.643458   233.9142   139.3   443.0228 6.916593          ?        ? 
1 1 1    6   20    9 o 45.04757 1.068103   21.82501   199.6   20.29870 0.9623086          ?        ? 
1 1 1    6   20   10 o 9.612402 3.550951   9.306206    95.9  0.7217315 0.9021643          ?        ? 
1 1 1    6   20   11 o 70.30918 1.283139   85.22742   126.7   49.46868 1.804329          ?        ? 
1 1 1    6   20   12 o 55.92937 1.263550   64.04617   148.3   31.30510 1.413391          ?        ? 
1 1 1    6   20   13 o 116.3357 1.305398   131.3708   104.6   135.4750 3.037287          ?        ? 
1 1 1    6   20   14 o 114.5166 1.339264   103.3226   213.2   131.2950 3.067359          ?        ? 
1 1 1    6   20   15 o 18.16102 3.264932   23.55686   214.1   3.428224 1.142741          ?        ? 
1 1 1    6   20   16 o 86.17408 1.256291   107.5037   253.3   74.39848 2.165194          ?        ? 
1 1 1    6   20   17 o 27.39644 1.920915   28.92062   225.9   7.548109 1.052525          ?        ? 
1 1 1    6   20   18 o 107.0456 1.165852   104.9589   280.2   114.9658 2.495988          ?        ? 
1 1 1    6   20   19 o 34.63782 1.692967   42.09562    57.8   12.11907 1.172814          ?        ? 
1 1 1    6   20   20 o 17.29295 3.513260   26.90245     5.7   3.277864 1.172814          ?        ? 
1 1 1    6   20   21 o 11.42577 4.018961   5.587536   197.2   1.353247 1.142741          ?        ? 
1 1 1    6   20   22 o 45.59464 1.418042   45.25053   213.5   21.20086 1.293102          ?        ? 
1 1 1    6   21    0 o 49.92487 1.448325   45.02513   180.0   24.98995 1.443463   24.98995 1.443463 
1 1 1    6   21    1 o 333.0131 2.171792   298.6413   333.7   1109.422 14.46470          ?        ? 
1 1 1    6   21    2 o 155.8678 1.263716   211.8053   267.2   242.9829 3.939451          ?        ? 
1 1 1    6   21    3 o 122.4663 1.166384   93.70380   135.2   149.9998 2.856854          ?        ? 
1 1 1    6   21    4 o 145.0963 1.284990   132.3610   325.6   210.5652 3.728946          ?        ? 
1 1 1    6   21    5 o 120.2352 1.138005   203.4671   176.7   144.5869 2.736565          ?        ? 
1 1 1    6   21    6 o 243.4179 1.853118   302.9027    57.8   592.8423 9.021644          ?        ? 
1 1 1    6   21    7 o 210.3515 1.736981   226.4457    70.7   442.7221 7.307531          ?        ? 
1 1 1    6   21    8 o 233.3008 1.894809   258.1689    33.0   544.7569 8.841210          ?        ? 
1 1 1    6   21    9 o 195.6440 1.567826   220.7817    33.9   383.0289 6.134717          ?        ? 
1 1 1    6   21   10 o 188.4651 1.779133   183.6474    10.1   355.5731 6.706088          ?        ? 
1 1 1    6   21   11 o 155.1803 1.395277   193.1470   126.9   240.9982 4.330389          ?        ? 
1 1 1    6   21   12 o 100.6588 1.269702   101.0170   272.3   101.4033 2.556132          ?        ? 
1 1 1    6   21   13 f 106.1120 1.346150   86.16355   179.3   112.7104 2.856854          ?        ? 
1 1 1    6   21   14 o 37.76247 1.592700   31.23193   264.4   14.28427 1.202886          ?        ? 
1 1 1    6   21   15 o 51.56989 1.399521   61.97628    20.5   26.64392 1.443463          ?        ? 
1 1 1    6   21   16 o 25.81232 2.330062   27.53183   122.5   6.706088 1.202886          ?        ? 
1 1 1    6   21   17 o 45.85562 1.409971   35.56463   209.1   21.11065 1.293102          ?        ? 
1 1 1    6   21   18 o 66.99506 1.144621   65.97209   269.5   45.04807 1.533679          ?        ? 
1 1 1    6   21   19 o 12.66269 3.830585   10.12868   163.7   1.714112 1.052525          ?        ? 
1 1 1    6   21   20 f 33.50439 1.795117   33.73284   154.5   11.42741 1.202886          ?        ? 
1 1 1    6   21   21 o 14.70471 3.685094   16.08336   173.3   2.465916 1.082597          ?        ? 
1 1 1    6   21   22 f 22.28236 2.699189   16.53673   310.6   5.382914 1.202886          ?        ? 
1 1 1    6   22    0 o 584.6862 4.940929   566.9161     0.0   3423.473 57.76859   3423.473 57.76859 
1 1 1    6   22    1 f 285.5276 1.995839   239.2352   282.7   815.5867 11.39734          ?        ? 
1 1 1    6   22    2 o 211.6037 1.499318   169.0134    99.6   447.8645 6.345222          ?        ? 
1 1 1    6   22    3 o 161.7246 1.320221   156.5926   145.5   261.5976 4.270245          ?        ? 
1 1 1    6   22    4 o 378.8917 2.563609   323.9336   209.7   1436.757 19.42661          ?        ? 
1 1 1    6   22    5 o 191.5227 1.499503   166.7889   339.3   366.9403 5.743780          ?        ? 
1 1 1    6   22    6 o 51.58283 1.107676   23.96961   288.1   26.61385 1.142741          ?        ? 
1 1 1    6   22    7 o 47.07107 1.149960   28.37188   179.4   22.16317 1.082597          ?        ? 
1 1 1    6   22    8 o 45.97137 1.144761   64.38892   187.5   21.14072 1.052525          ?        ? 
1 1 1    6   22    9 o 96.89141 1.086293   93.31453   269.4   93.91531 2.105050          ?        ? 
1 1 1    6   22   10 o 45.03782 1.302032   54.18019   137.7   20.29870 1.172814          ?        ? 
1 1 1    6   22   11 o 120.6375 1.221457   116.8461    13.8   145.6394 2.947070          ?        ? 
1 1 1    6   22   12 o 38.27708 1.649852   50.34550    87.0   14.67521 1.263030          ?        ? 
1 1 1    6   22   13 o 78.15718 1.154295   90.24664    20.8   61.13667 1.804329          ?        ? 
1 1 1    6   22   14 o 15.86314 3.983351   18.65120   157.4   2.646349 1.263030          ?        ? 
1 1 1    6   22   15 f 56.56071 1.435533   64.49111    39.9   32.05691 1.623896          ?        ? 
1 1 1    6   22   16 o 88.11548 1.262740   85.38103    88.9   77.82671 2.225339          ?        ? 
1 1 1    6   22   17 o 27.73020 2.006241   29.58854   172.7   7.758613 1.112669          ?        ? 
1 1 1    6   22   18 o 33.26847 1.898239   22.79070   220.2   11.18684 1.263030          ?        ? 
1 1 1    6   22   19 f 22.03801 2.524432   13.98475   288.0   4.991976 1.112669          ?        ? 
1 1 1    6   22   20 o 14.55628 3.934629   18.60746   346.6   2.405771 1.172814          ?        ? 
1 1 1    6   22   21 o 12.52995 4.026275   15.22750   320.2   1.804329 1.142741          ?        ? 
1 1 1    6   22   22 o 27.09240 2.164470   21.20554     2.0   7.758613 1.172814          ?        ? 
1 1 1    6   23    0 o 234.2261 2.285820   250.4874    -0.0   548.9370 10.70568   548.9370 10.70568 
1 1 1    6   23    1 o 44.91723 1.104677   41.46762    79.7   20.17841 0.9923807          ?        ? 
1 1 1    6   23    2 o 612.7955 3.658445   594.4434     2.7   3761.394 44.83757          ?        ? 
1 1 1    6   23    3 o 53.75443 0.9790124   76.13199   171.9   28.89933 1.052525          ?        ? 
1 1 1    6   23    4 o 32.80573 1.420844   40.36782    61.8   10.76583 0.9322364          ?        ? 
1 1 1    6   23    5 o 238.0244 1.794036   270.7741   206.1   566.8900 8.540489          ?        ? 
1 1 1    6   23    6 o 96.60126 1.151817   66.09208   308.0   93.34393 2.225339          ?        ? 
1 1 1    6   23    7 o 59.33329 1.064352   72.64799    79.9   35.21448 1.263030          ?        ? 
1 1 1    6   23    8 o 89.67291 1.089900   82.50142   123.7   80.44299 1.954689          ?        ? 
1 1 1    6   23    9 o 163.7090 1.515465   221.3519    47.5   268.2435 4.961904          ?        ? 
1 1 1    6   23   10 o 74.18587 1.074210   78.22039    57.6   55.06210 1.593824          ?        ? 
1 1 1    6   23   11 o 77.04000 1.171034   95.33649   258.3   59.39249 1.804329          ?        ? 
1 1 1    6   23   12 o 147.4533 1.407210   178.6926   177.6   217.6622 4.149956          ?        ? 
1 1 1    6   23   13 o 89.44773 1.176693   86.51566   215.9   80.08212 2.105050          ?        ? 
1 1 1    6   23   14 o 117.1701 1.283269   133.9982   169.8   137.4899 3.007215          ?        ? 
1 1 1    6   23   15 o 10.23878 3.867168   7.849043   209.4  0.7818757 1.082597          ?        ? 
1 1 1    6   23   16 o 34.93523 1.850714   38.44468   286.4   12.26943 1.293102          ?        ? 
1 1 1    6   23   17 o 49.56215 1.456215   47.17504   213.0   24.68923 1.443463          ?        ? 
1 1 1    6   23   18 o 41.13958 1.644702   44.37801   135.8   17.08098 1.353247          ?        ? 
1 1 1    6   23   19 o 11.40407 3.812089   10.32711   159.8   1.353247 1.022453          ?        ? 
1 1 1    6   23   20 o 31.52377 1.907903   21.40654   163.8   10.16438 1.202886          ?        ? 
1 1 1    6   23   21 o 9.394114 3.703455   4.688922    83.3  0.7217315 1.022453          ?        ? 
1 1 1    6   23   22 o 10.47669 4.042867   11.62442   154.6   1.172814 1.202886          ?        ? 
1 1 1    6   24    0 o 489.0502 4.292809   522.0613   180.0   2395.698 41.98072   2395.698 41.98072 
1 1 1    6   24    1 o 70.69151 0.9358793   78.41330    68.6   49.97990 1.323174          ?        ? 
1 1 1    6   24    2 o 151.4964 1.230704   138.9642   181.6   229.5708 3.728946          ?        ? 
1 1 1    6   24    3 o 115.5264 1.054237   151.2278   137.8   133.4902 2.435844          ?        ? 
1 1 1    6   24    4 o 166.6824 1.371160   160.8787    36.5   277.9268 4.570966          ?        ? 
1 1 1    6   24    5 o 125.1129 1.249872   148.3248   267.9   156.5857 3.127503          ?        ? 
1 1 1    6   24    6 o 174.4509 1.525578   204.1360   332.8   304.5105 5.322770          ?        ? 
1 1 1    6   24    7 o 107.0324 1.137900   100.2727   292.9   114.6049 2.435844          ?        ? 
1 1 1    6   24    8 o 162.0547 1.549492   154.4476   342.4   262.8305 5.022048          ?        ? 
1 1 1    6   24    9 o 99.94269 1.053129   104.4704   327.1   99.92973 2.105050          ?        ? 
1 1 1    6   24   10 o 41.92644 1.291067   17.46375    17.6   17.59221 1.082597          ?        ? 
1 1 1    6   24   11 o 73.17549 1.150686   63.03992   119.0   53.58856 1.684040          ?        ? 
1 1 1    6   24   12 f 72.55704 1.119048   81.05337   123.3   52.68640 1.623896          ?        ? 
1 1 1    6   24   13 o 28.97393 2.023912   37.68293   236.4   8.420200 1.172814          ?        ? 
1 1 1    6   24   14 o 99.47759 1.163858   94.13040     3.8   99.08772 2.315555          ?        ? 
1 1 1    6   24   15 o 38.28481 1.610244   40.53352   280.0   14.70528 1.232958          ?        ? 
1 1 1    6   24   16 o 39.06899 1.500952   39.63411    62.0   15.33679 1.172814          ?        ? 
1 1 1    6   24   17 o 29.30691 2.052222   29.89326    20.5   8.690849 1.202886          ?        ? 
1 1 1    6   24   18 o 24.25303 2.169883   15.48338   167.9   5.984357 1.052525          ?        ? 
1 1 1    6   24   19 o 14.70743 4.126904   16.33086     3.6   2.435844 1.263030          ?        ? 
1 1 1    6   24   20 o 19.93759 3.092043   16.80896   235.0   4.240172 1.232958          ?        ? 
1 1 1    6   24   21 o 10.23195 3.982980   5.265707   147.7  0.9923807 1.172814          ?        ? 
1 1 1    6   25    0 o 117.7216 1.597229   86.68510   180.0   138.6927 3.759018   138.6927 3.759018 
1 1 1    6   25    1 o 95.58965 0.9595186   86.80949   359.1   91.38924 1.834401          ?        ? 
1 1 1    6   25    2 o 114.6116 1.049532   99.25909    82.3   131.3852 2.405771          ?        ? 
1 1 1    6   25    3 o 75.36269 0.9776290   68.05521   241.2   56.80628 1.473535          ?        ? 
1 1 1    6   25    4 o 116.6973 1.159621   144.2183   190.5   136.2268 2.706493          ?        ? 
1 1 1    6   25    5 o 284.9890 2.231756   289.0007   203.5   813.2109 12.72052          ?        ? 
1 1 1    6   25    6 o 76.95372 1.133268   71.98577   160.5   59.24213 1.744184          ?        ? 
1 1 1    6   25    7 f 19.68019 2.215660   67.34474   207.8   3.879307 0.8720922          ?        ? 
1 1 1    6   25    8 f 167.3352 1.491610   184.1940   311.5   280.2724 4.991976          ?        ? 
1 1 1    6   25    9 o 96.91349 1.086046   110.8242   242.6   93.97545 2.105050          ?        ? 
1 1 1    6   25   10 o 76.49316 1.081121   101.0763    27.0   58.55046 1.653968          ?        ? 
1 1 1    6   25   11 o 62.95231 1.265898   58.19459   344.6   39.66516 1.593824          ?        ? 
1 1 1    6   25   12 o 64.17828 1.218287   50.92070   339.0   41.22891 1.563751          ?        ? 
1 1 1    6   25   13 o 31.59250 1.951346   13.50584   150.1   10.01402 1.232958          ?        ? 
1 1 1    6   25   14 o 35.26662 1.705417   33.33332    23.1   12.47994 1.202886          ?        ? 
1 1 1    6   25   15 o 45.01622 1.436263   44.64262   198.4   20.32877 1.293102          ?        ? 
1 1 1    6   25   16 o 32.54842 1.847840   39.60024   128.5   10.67561 1.202886          ?        ? 
1 1 1    6   25   17 o 84.00088 1.217193   85.66703   173.0   70.88004 2.044906          ?        ? 
1 1 1    6   25   18 o 46.55051 1.421224   43.69985   122.0   21.86245 1.323174          ?        ? 
1 1 1    6   25   19 o 25.63559 2.170166   28.74660   240.1   6.766232 1.112669          ?        ? 
1 1 1    6   25   20 f 24.54973 2.143659   20.38279    80.0   6.255006 1.052525          ?        ? 
1 1 1    6   25   21 o 12.13308 3.920903   19.60818    74.3   1.774257 1.082597          ?        ? 
1 1 1    6   26    0 o 248.3054 2.416649   273.7566     0.0   617.1406 11.99879   617.1406 11.99879 
1 1 1    6   26    1 o 159.7652 1.251711   158.9985    61.3   255.3426 3.999595          ?        ? 
1 1 1    6   26    2 o 178.3300 1.365919   176.2482    65.3   318.1633 4.871688          ?        ? 
1 1 1    6   26    3 o 180.9183 1.437799   162.4983   133.5   327.4857 5.202481          ?        ? 
1 1 1    6   26    4 o 110.3963 1.103228   113.1655   180.0   121.9125 2.435844          ?        ? 
1 1 1    6   26    5 o 135.5390 1.253570   106.9644   173.5   183.8009 3.398152          ?        ? 
1 1 1    6   26    6 o 132.2605 1.261907   139.4273   181.2   175.0199 3.338008          ?        ? 
1 1 1    6   26    7 o 140.2678 1.254187   169.1036   147.7   196.8823 3.518441          ?        ? 
1 1 1    6   26    8 o 60.00634 1.077471   59.30729   162.5   36.02643 1.293102          ?        ? 
1 1 1    6   26    9 o 79.10459 1.064439   61.40693   166.8   62.61020 1.684040          ?        ? 
1 1 1    6   26   10 o 112.7198 1.107165   122.1445   293.3   127.1450 2.495988          ?        ? 
1 1 1    6   26   11 o 56.56233 1.275993   92.11964   180.0   32.02683 1.443463          ?        ? 
1 1 1    6   26   12 o 67.43591 1.248623   58.58215   186.4   45.52922 1.684040          ?        ? 
1 1 1    6   26   13 o 24.01491 2.567067   32.36034    53.6   5.803924 1.232958          ?        ? 
1 1 1    6   26   14 o 49.59695 1.424877   49.78233   304.5   24.65916 1.413391          ?        ? 
1 1 1    6   26   15 o 50.76548 1.362460   48.68287   250.7   25.86205 1.383319          ?        ? 
1 1 1    6   26   16 o 23.07118 2.541729   14.96825   109.6   5.412986 1.172814          ?        ? 
1 1 1    6   26   17 o 45.03138 1.535949   38.26694    74.5   20.44906 1.383319          ?        ? 
1 1 1    6   26   18 o 9.752592 3.892892   10.02928   310.2  0.6315150 1.142741          ?        ? 
1 1 1    6   26   19 o 24.91693 2.413792   20.65960   185.7   6.435439 1.202886          ?        ? 
1 1 1    6   26   20 o 33.84055 1.643988   35.62128   342.5   11.72814 1.112669          ?        ? 
1 1 1    6   26   21 o 8.586886 3.637777   9.699826   339.8  0.3909379 1.082597          ?        ? 
1 1 1    6   27    0 o 267.8160 2.622457   271.7665     0.0   718.0927 14.04369   718.0927 14.04369 
1 1 1    6   27    1 o 242.8226 1.709048   206.2291     4.4   590.0756 8.299912          ?        ? 
1 1 1    6   27    2 o 218.8804 1.566255   213.5185     3.4   479.4101 6.856449          ?        ? 
1 1 1    6   27    3 o 167.6059 1.381547   191.1497     2.5   281.0844 4.631110          ?        ? 
1 1 1    6   27    4 o 38.57039 1.364421   32.52414     0.0   14.88571 1.052525          ?        ? 
1 1 1    6   27    5 o 60.83153 1.038138   60.46339   260.7   37.01881 1.263030          ?        ? 
1 1 1    6   27    6 o 111.6991 1.090360   117.5347   259.0   124.8295 2.435844          ?        ? 
1 1 1    6   27    7 f 63.72456 1.038198   68.50218   301.4   40.62747 1.323174          ?        ? 
1 1 1    6   27    8 o 128.7103 1.261667   155.2323   188.3   165.7877 3.247792          ?        ? 
1 1 1    6   27    9 o 91.46539 1.117858   93.97191   131.8   83.72085 2.044906          ?        ? 
1 1 1    6   27   10 f 114.1573 1.159080   115.9235   173.6   130.4229 2.646349          ?        ? 
1 1 1    6   27   11 o 14.74150 4.188464   13.51397    63.6   2.255411 1.293102          ?        ? 
1 1 1    6   27   12 o 37.57758 1.840617   31.57187   331.1   14.16398 1.383319          ?        ? 
1 1 1    6   27   13 f 30.44715 2.172903   45.04167   357.4   9.322365 1.323174          ?        ? 
1 1 1    6   27   14 o 69.06052 1.284567   58.74308   195.7   47.81471 1.774257          ?        ? 
1 1 1    6   27   15 o 42.43317 1.559128   49.28288   283.9   18.10343 1.323174          ?        ? 
1 1 1    6   27   16 o 54.49452 1.379595   47.63187   213.6   29.86164 1.503607          ?        ? 
1 1 1    6   27   17 o 35.67281 1.728148   30.20292   311.1   12.87088 1.232958          ?        ? 
1 1 1    6   27   18 o 7.707187 3.418162   11.26871   290.7 -0.2405772 1.052525          ?        ? 
1 1 1    6   27   19 o 18.33693 3.407429   11.05926    93.8   3.728946 1.202886          ?        ? 
1 1 1    6   27   20 o 29.54206 2.137681   22.39857   319.4   9.141932 1.263030          ?        ? 
1 1 1    6   28    0 o 67.31561 1.318994   13.11001   180.0   45.37886 1.774257   45.37886 1.774257 
1 1 1    6   28    1 o 211.2765 1.608391   208.6038   178.4   446.7518 6.796305          ?        ? 
1 1 1    6   28    2 o 151.9937 1.236570   109.3641    12.0   231.1345 3.759018          ?        ? 
1 1 1    6   28    3 o 126.9337 1.089796   123.8029    65.1   161.1867 2.766637          ?        ? 
1 1 1    6   28    4 o 41.13517 1.169691   38.75304   149.9   16.93062 0.9623086          ?        ? 
1 1 1    6   28    5 f 90.76916 1.060171   70.94120   235.1   82.42775 1.924617          ?        ? 
1 1 1    6   28    6 o 75.84863 1.030837   61.00549   308.5   57.55808 1.563751          ?        ? 
1 1 1    6   28    7 o 51.04378 1.207746   34.86953   248.3   26.07255 1.232958          ?        ? 
1 1 1    6   28    8 o 13.87273 3.472975   5.381538    81.9   2.014834 0.9623086          ?        ? 
1 1 1    6   28    9 o 80.12040 1.069710   65.12130    28.0   64.23410 1.714112          ?        ? 
1 1 1    6   28   10 o 118.6637 1.216432   122.1853   181.9   140.9482 2.886926          ?        ? 
1 1 1    6   28   11 o 68.46679 1.317667   53.45285    49.1   46.94262 1.804329          ?        ? 
1 1 1    6   28   12 o 92.45732 1.252229   74.73130   350.7   85.61540 2.315555          ?        ? 
1 1 1    6   28   13 o 76.73981 1.234395   66.51600   244.6   59.00155 1.894545          ?        ? 
1 1 1    6   28   14 o 59.73119 1.434855   56.54900   144.2   35.81593 1.714112          ?        ? 
1 1 1    6   28   15 o 49.24540 1.496115   57.86092   311.7   24.38851 1.473535          ?        ? 
1 1 1    6   28   16 o 19.27157 2.886815   22.88193   252.6   3.819162 1.112669          ?        ? 
1 1 1    6   28   17 o 9.368160 3.893846   11.95381   229.7  0.3608657 1.202886          ?        ? 
1 1 1    6   28   18 o 56.21420 1.364139   55.13093     7.6   31.96669 1.533679          ?        ? 
1 1 1    6   28   19 f 41.49277 1.666939   29.74043   355.6   17.62228 1.383319          ?        ? 
1 1 1    6   28   20 o 24.96936 2.348506   22.55928    21.6   6.645944 1.172814          ?        ? 
1 1 1    6   29    0 o 12.79115 4.714697   13.93311   180.0   2.195267 1.112669   2.195267 1.112669 
1 1 1    6   29    1 o 107.2122 1.037820   83.35070    89.6   114.9959 2.225339          ?        ? 
1 1 1    6   29    2 o 102.3354 1.013813   128.4834   162.4   104.7713 2.074978          ?        ? 
1 1 1    6   29    3 o 307.2485 2.001557   332.6452   105.6   945.5585 12.29951          ?        ? 
1 1 1    6   29    4 f 158.4309 1.243271   164.8766   144.1   251.1626 3.939451          ?        ? 
1 1 1    6   29    5 o 60.97300 1.109710   58.12091   191.9   37.19924 1.353247          ?        ? 
1 1 1    6   29    6 o 63.31923 1.092337   73.41695   328.7   40.11624 1.383319          ?        ? 
1 1 1    6   29    7 o 43.60505 1.379296   33.13237   247.7   19.03567 1.202886          ?        ? 
1 1 1    6   29    8 o 90.87364 1.125137   72.80383   318.1   82.63825 2.044906          ?        ? 
1 1 1    6   29    9 o 82.39101 1.058480   83.39935   287.6   67.93298 1.744184          ?        ? 
1 1 1    6   29   10 o 205.1797 1.568244   187.3844   316.0   421.7618 6.435439          ?        ? 
1 1 1    6   29   11 o 48.28009 1.588315   33.29581   336.3   23.36606 1.533679          ?        ? 
1 1 1    6   29   12 o 44.51860 1.553641   29.85842    13.9   19.87769 1.383319          ?        ? 
1 1 1    6   29   13 f 25.95245 2.433354   33.44727    43.8   6.796305 1.263030          ?        ? 
1 1 1    6   29   14 f 43.70315 1.651441   49.92820    25.3   19.21610 1.443463          ?        ? 
1 1 1    6   29   15 o 14.90715 3.964697   4.982430   159.1   2.405771 1.202886          ?        ? 
1 1 1    6   29   16 o 18.47997 3.463885   23.61508    32.3   3.668802 1.232958          ?        ? 
1 1 1    6   29   17 o 25.81872 2.504195   27.02146   208.2   6.886521 1.293102          ?        ? 
1 1 1    6   29   18 o 36.84383 1.795653   31.67173   214.2   13.86326 1.323174          ?        ? 
1 1 1    6   29   19 o 28.22583 2.130825   30.61637   111.2   8.299912 1.202886          ?        ? 
1 1 1    6   29   20 o 21.75368 2.764786   19.92155   208.4   5.202481 1.202886          ?        ? 
1 1 1    6   30    0 o 160.2770 1.670279   192.5985   180.0   257.1169 5.352841   257.1169 5.352841 
1 1 1    6   30    1 o 30.51778 1.527366   58.12942   319.5   9.322365 0.9322364          ?        ? 
1 1 1    6   30    2 f 58.97237 1.019872   39.15076    59.7   34.79347 1.202886          ?        ? 
1 1 1    6   30    3 o 141.8575 1.144737   133.6843     8.7   201.3631 3.247792          ?        ? 
1 1 1    6   30    4 o 159.9841 1.306389   154.3504   101.0   256.1545 4.180028          ?        ? 
1 1 1    6   30    5 o 204.4369 1.640137   184.8659   317.3   418.5441 6.706088          ?        ? 
1 1 1    6   30    6 o 56.86114 1.163514   50.06621    56.7   32.35763 1.323174          ?        ? 
1 1 1    6   30    7 o 23.67944 2.285944   29.47227   292.4   5.623491 1.082597          ?        ? 
1 1 1    6   30    8 o 84.35370 1.087327   64.84953   147.2   71.21084 1.834401          ?        ? 
1 1 1    6   30    9 o 130.9755 1.262807   124.4433   173.6   171.7420 3.307936          ?        ? 
1 1 1    6   30   10 o 131.9955 1.173310   122.5444    86.6   174.4485 3.097431          ?        ? 
1 1 1    6   30   11 o 81.26752 1.239630   82.07529    12.6   66.15872 2.014834          ?        ? 
1 1 1    6   30   12 o 19.28940 3.640763   7.754215   203.4   3.909379 1.353247          ?        ? 
1 1 1    6   30   13 o 27.20480 2.376607   34.86107    25.4   7.487964 1.293102          ?        ? 
1 1 1    6   30   14 o 30.68193 2.205282   15.68852   173.0   9.532870 1.353247          ?        ? 
1 1 1    6   30   15 o 102.1689 1.265651   91.80146   105.4   104.9518 2.586205          ?        ? 
1 1 1    6   30   16 o 66.92043 1.280709   51.12387   123.0   45.13829 1.714112          ?        ? 
1 1 1    6   30   17 o 7.174715 3.359358   9.822404   293.8 -0.9923807 1.202886          ?        ? 
1 1 1    6   30   18 o 28.33435 2.281863   19.59155    74.0   8.360056 1.293102          ?        ? 
1 1 1    6   30   19 o 28.55410 2.264302   24.76661   332.9   8.630706 1.293102          ?        ? 
1 1 1    6   31    0 o 71.74986 1.489322   57.18618   180.0   51.57373 2.135122   51.57373 2.135122 
1 1 1    6   31    1 o 127.3922 1.156692   123.2566   248.2   162.3896 2.947070          ?        ? 
1 1 1    6   31    2 f 145.2681 1.169614   137.5221   298.4   211.1666 3.398152          ?        ? 
1 1 1    6   31    3 o 98.16237 1.010958   117.4140   223.1   96.41130 1.984761          ?        ? 
1 1 1    6   31    4 o 62.02382 0.9939391   77.99496   249.5   38.49234 1.232958          ?        ? 
1 1 1    6   31    5 o 54.51317 1.213628   47.33887   130.9   29.74135 1.323174          ?        ? 
1 1 1    6   31    6 o 46.86016 1.379746   36.60007   273.3   21.98274 1.293102          ?        ? 
1 1 1    6   31    7 f 92.57146 1.120744   71.12335   330.5   85.76576 2.074978          ?        ? 
1 1 1    6   31    8 o 47.68258 1.324414   49.28871     7.5   22.76461 1.263030          ?        ? 
1 1 1    6   31    9 o 82.52061 1.129701   65.57046    99.5   68.17355 1.864473          ?        ? 
1 1 1    6   31   10 o 69.85515 1.183855   83.63442   161.4   48.86723 1.653968          ?        ? 
1 1 1    6   31   11 o 9.620031 3.966153   24.30551   198.0  0.3007214 1.232958          ?        ? 
1 1 1    6   31   12 o 54.58263 1.432463   61.14015    60.0   29.89171 1.563751          ?        ? 
1 1 1    6   31   13 o 17.74943 3.757776   33.79942   141.8   3.368080 1.293102          ?        ? 
1 1 1    6   31   14 o 56.29311 1.415647   59.34195   328.2   31.87647 1.593824          ?        ? 
1 1 1    6   31   15 o 43.22316 1.704566   35.05951    94.5   18.88531 1.473535          ?        ? 
1 1 1    6   31   16 o 17.01986 3.560589   11.41696   103.9   3.187647 1.172814          ?        ? 
1 1 1    6   31   17 o 24.03332 2.690228   32.95214    27.7   6.044501 1.293102          ?        ? 
1 1 1    6   31   18 o 16.01446 3.883924   12.49455   295.1   3.007215 1.232958          ?        ? 
1 1 1    6   31   19 o 23.99986 2.631329   18.42109   214.5   6.255006 1.263030          ?        ? 
1 1 1    6   32    0 o 54.03942 1.505091   73.33968    -0.0   29.29027 1.623896   29.29027 1.623896 
1 1 1    6   32    1 o 31.28984 1.489679   41.89055    86.7   9.803518 0.9322364          ?        ? 
1 1 1    6   32    2 o 72.85400 0.9906545   66.25315   158.5   53.10741 1.443463          ?        ? 
1 1 1    6   32    3 o 86.16022 1.012175   85.32369   319.1   74.27820 1.744184          ?        ? 
1 1 1    6   32    4 o 32.09522 1.545995   28.78829   203.5   10.31474 0.9923807          ?        ? 
1 1 1    6   32    5 o 85.94164 1.119723   86.99112    18.3   73.91734 1.924617          ?        ? 
1 1 1    6   32    6 o 58.59871 1.231651   76.18364   265.8   34.37246 1.443463          ?        ? 
1 1 1    6   32    7 f 136.3340 1.268318   125.4453   270.7   186.0864 3.458297          ?        ? 
1 1 1    6   32    8 o 51.16882 1.322335   62.38080   351.9   26.22291 1.353247          ?        ? 
1 1 1    6   32    9 o 43.51117 1.520500   41.98013    43.1   18.97552 1.323174          ?        ? 
1 1 1    6   32   10 o 41.15895 1.570864   28.99616    14.0   16.99076 1.293102          ?        ? 
1 1 1    6   32   11 o 16.92474 3.742239   26.84827   254.2   3.037287 1.232958          ?        ? 
1 1 1    6   32   12 o 28.69257 2.305779   17.20901   156.7   8.329985 1.323174          ?        ? 
1 1 1    6   32   13 o 37.60950 1.879034   42.07698   146.5   14.28427 1.413391          ?        ? 
1 1 1    6   32   14 o 46.37334 1.523926   43.80964   106.4   21.68202 1.413391          ?        ? 
1 1 1    6   32   15 o 28.44886 2.431237   20.87753    92.1   8.329985 1.383319          ?        ? 
1 1 1    6   32   16 o 19.97364 3.161742   12.70546   131.6   4.240172 1.263030          ?        ? 
1 1 1    6   32   17 o 11.23647 4.231139   15.41852   261.1   1.232958 1.293102          ?        ? 
1 1 1    6   32   18 o 19.42452 3.618247   25.62856   174.2   4.390533 1.353247          ?        ? 
1 1 1    6   33    0 o 88.63992 1.374750   93.87936    -0.0   78.66873 2.435844   78.66873 2.435844 
1 1 1    6   33    1 o 104.6375 1.005878   83.92332   277.3   109.5528 2.105050          ?        ? 
1 1 1    6   33    2 o 110.5649 1.101544   100.6373   212.1   122.3335 2.435844          ?        ? 
1 1 1    6   33    3 o 94.91977 1.013813   92.97726   135.5   90.15629 1.924617          ?        ? 
1 1 1    6   33    4 o 79.98854 0.9962826   80.26285   209.6   64.02360 1.593824          ?        ? 
1 1 1    6   33    5 o 54.56247 1.240089   51.18375   138.1   29.80149 1.353247          ?        ? 
1 1 1    6   33    6 o 109.0911 1.226690   89.68472   160.6   119.1458 2.676421          ?        ? 
1 1 1    6   33    7 o 29.06448 2.069340   14.13760   283.7   8.480345 1.202886          ?        ? 
1 1 1    6   33    8 o 37.34165 1.691181   38.66956   253.5   13.98355 1.263030          ?        ? 
1 1 1    6   33    9 o 71.06024 1.184938   78.99731   302.1   50.58134 1.684040          ?        ? 
1 1 1    6   33   10 o 56.46811 1.278122   51.04095   285.4   31.96669 1.443463          ?        ? 
1 1 1    6   33   11 o 30.99858 1.891721   29.64596    70.9   9.683230 1.172814          ?        ? 
1 1 1    6   33   12 o 48.84124 1.539280   45.69709    32.2   23.99757 1.503607          ?        ? 
1 1 1    6   33   13 o 73.88499 1.302441   70.31885   323.0   54.88166 1.924617          ?        ? 
1 1 1    6   33   14 o 21.35656 3.238627   18.22635   255.5   4.751399 1.383319          ?        ? 
1 1 1    6   33   15 o 17.42195 3.732836   15.44873   171.6   3.368080 1.263030          ?        ? 
1 1 1    6   33   16 o 33.98845 1.990745   42.47877   171.0   11.84843 1.353247          ?        ? 
1 1 1    6   33   17 o 12.61757 4.287051   11.94932   205.1   1.834401 1.293102          ?        ? 
1 1 1    6   33   18 o 24.36558 2.776963   19.47456   349.9   6.495584 1.353247          ?        ? 
1 1 1    6   34    0 o 88.14669 1.519171   61.05882   180.0   77.82671 2.676421   77.82671 2.676421 
1 1 1    6   34    1 o 84.51806 1.014051   72.28967    55.5   71.48148 1.714112          ?        ? 
1 1 1    6   34    2 o 103.8928 1.070978   101.0138    80.3   108.0191 2.225339          ?        ? 
1 1 1    6   34    3 o 54.95132 1.121864   64.05353   136.8   30.22251 1.232958          ?        ? 
1 1 1    6   34    4 o 145.1806 1.242817   136.9972   322.4   211.0163 3.608657          ?        ? 
1 1 1    6   34    5 o 75.80676 1.130580   61.42154     2.8   57.52802 1.714112          ?        ? 
1 1 1    6   34    6 o 50.27637 1.345808   43.78737   252.6   25.32075 1.353247          ?        ? 
1 1 1    6   34    7 o 51.97638 1.330719   51.26324    67.0   27.06493 1.383319          ?        ? 
1 1 1    6   34    8 o 44.69103 1.514002   30.36742   146.9   20.02805 1.353247          ?        ? 
1 1 1    6   34    9 o 21.39046 2.811735   10.82520   220.7   4.631110 1.202886          ?        ? 
1 1 1    6   34   10 o 58.93582 1.301144   58.54525    67.4   34.85361 1.533679          ?        ? 
1 1 1    6   34   11 o 36.20456 1.744297   36.68972   311.2   13.20167 1.263030          ?        ? 
1 1 1    6   34   12 o 39.17435 1.765592   24.95881   198.3   15.48715 1.383319          ?        ? 
1 1 1    6   34   13 o 40.58080 1.778505   39.22942   177.9   16.65997 1.443463          ?        ? 
1 1 1    6   34   14 o 15.23416 4.206769   24.00282    98.0   2.616277 1.323174          ?        ? 
1 1 1    6   34   15 o 16.10500 3.946698   9.961559   233.0   2.947070 1.263030          ?        ? 
1 1 1    6   34   16 o 13.07497 4.434078   4.244507    92.0   1.954689 1.383319          ?        ? 
1 1 1    6   34   17 o 10.77390 4.223071   20.18903   216.3   1.142741 1.323174          ?        ? 
1 1 1    6   35    0 o 43.41044 1.877975   16.04871   360.0   18.97552 1.623896   18.97552 1.623896 
1 1 1    6   35    1 o 75.77257 1.091403   60.31961    35.1   57.46787 1.653968          ?        ? 
1 1 1    6   35    2 o 68.44011 1.054545   54.28984   113.7   46.88247 1.443463          ?        ? 
1 1 1    6   35    3 o 122.0503 1.133401   111.5192   196.4   149.1278 2.766637          ?        ? 
1 1 1    6   35    4 o 64.84593 1.136182   51.16438   253.1   42.10100 1.473535          ?        ? 
1 1 1    6   35    5 o 51.13149 1.382114   42.84674   305.0   26.19284 1.413391          ?        ? 
1 1 1    6   35    6 o 59.08553 1.246951   51.06363    37.1   34.97390 1.473535          ?        ? 
1 1 1    6   35    7 o 61.30002 1.275490   56.98616   359.1   37.65033 1.563751          ?        ? 
1 1 1    6   35    8 o 50.87100 1.359634   58.48976    23.8   25.95226 1.383319          ?        ? 
1 1 1    6   35    9 o 17.15153 3.619250   26.28779    75.1   3.127503 1.202886          ?        ? 
1 1 1    6   35   10 o 63.78144 1.296590   52.70360   152.0   40.83797 1.653968          ?        ? 
1 1 1    6   35   11 o 59.05209 1.273120   63.95125   153.8   35.03405 1.503607          ?        ? 
1 1 1    6   35   12 o 15.42890 4.183167   8.239208   326.6   2.616277 1.323174          ?        ? 
1 1 1    6   35   13 o 36.96603 1.871067   31.60527    32.5   13.89333 1.383319          ?        ? 
1 1 1    6   35   14 o 11.44221 4.323059   6.667759   247.2   1.202886 1.353247          ?        ? 
1 1 1    6   35   15 o 17.39653 3.974723   16.07784   133.9   3.458297 1.353247          ?        ? 
1 1 1    6   35   16 o 7.152967 3.423313   6.324697   286.8  -1.503607 1.383319          ?        ? 
1 1 1    6   35   17 o 10.35774 4.223939   9.141311     5.8  0.9623086 1.383319          ?        ? 
1 1 1    6   36    0 o 36.45026 2.076642   45.94482   360.0   13.44225 1.503607   13.44225 1.503607 
1 1 1    6   36    1 o 14.84350 3.412182   38.85957   136.5   2.315555 0.9923807          ?        ? 
1 1 1    6   36    2 o 85.61690 1.018598   90.82681   341.0   73.37603 1.744184          ?        ? 
1 1 1    6   36    3 f 143.7708 1.181795   122.8120   247.9   206.9866 3.398152          ?        ? 
1 1 1    6   36    4 o 176.5074 1.337430   148.4884   248.1   312.1789 4.721327          ?        ? 
1 1 1    6   36    5 o 60.01483 1.252696   44.17804   252.6   36.08657 1.503607          ?        ? 
1 1 1    6   36    6 o 35.17025 1.752842   43.07954    97.5   12.41980 1.232958          ?        ? 
1 1 1    6   36    7 o 11.67103 4.121524   21.82761   272.2   1.232958 1.202886          ?        ? 
1 1 1    6   36    8 o 80.60612 1.193841   81.61983   320.4   65.16634 1.924617          ?        ? 
1 1 1    6   36    9 o 69.38674 1.278527   71.65177   336.7   48.32594 1.774257          ?        ? 
1 1 1    6   36   10 o 15.55774 3.797288   24.71147   263.8   2.616277 1.172814          ?        ? 
1 1 1    6   36   11 o 12.97716 4.126943   11.26271   270.5   1.774257 1.202886          ?        ? 
1 1 1    6   36   12 o 25.04445 2.701689   21.91580     2.6   6.465511 1.353247          ?        ? 
1 1 1    6   36   13 o 15.03133 4.289226   22.04149    72.9   2.556132 1.353247          ?        ? 
1 1 1    6   36   14 o 30.81229 2.391149   30.11192    91.8   9.833591 1.473535          ?        ? 
1 1 1    6   36   15 o 12.59596 4.334704   14.56456    74.6   1.804329 1.323174          ?        ? 
1 1 1    6   36   16 o 22.55763 3.199501   16.10182   218.3   5.683635 1.443463          ?        ? 
1 1 1    6   37    0 o 25.27824 3.177331   21.16871   180.0   6.495584 1.623896   6.495584 1.623896 
1 1 1    6   37    1 o 38.37406 1.488951   36.70554   167.2   14.76542 1.142741          ?        ? 
1 1 1    6   37    2 o 88.86658 1.099789   72.67660   217.4   79.08974 1.954689          ?        ? 
1 1 1    6   37    3 o 53.84908 1.228595   54.63966   344.2   29.04969 1.323174          ?        ? 
1 1 1    6   37    4 o 70.68478 1.084872   73.41753   340.8   50.04005 1.533679          ?        ? 
1 1 1    6   37    5 o 68.20124 1.168471   42.82365     2.2   46.61182 1.593824          ?        ? 
1 1 1    6   37    6 o 55.19819 1.307528   51.91346    12.9   30.55330 1.443463          ?        ? 
1 1 1    6   37    7 o 56.64611 1.300650   59.06285    89.7   32.20727 1.473535          ?        ? 
1 1 1    6   37    8 o 79.29754 1.194580   62.58227   303.4   63.09136 1.894545          ?        ? 
1 1 1    6   37    9 o 14.82414 3.902162   19.28245   187.3   2.375700 1.172814          ?        ? 
1 1 1    6   37   10 f 26.78301 2.077193   52.95140   294.8   7.277459 1.112669          ?        ? 
1 1 1    6   37   11 o 55.98632 1.369691   52.70346    10.6   31.57575 1.533679          ?        ? 
1 1 1    6   37   12 o 27.94303 2.636677   31.00665   309.2   8.089407 1.473535          ?        ? 
1 1 1    6   37   13 o 34.40672 2.053946   34.84151   327.0   12.14915 1.413391          ?        ? 
1 1 1    6   37   14 o 12.39852 4.458607   19.93287   267.2   1.653968 1.413391          ?        ? 
1 1 1    6   37   15 o 8.617633 3.865228   9.649799   324.8 -0.2105050 1.383319          ?        ? 
1 1 1    6   37   16 o 15.77194 4.407388   17.31146   209.6   3.217719 1.443463          ?        ? 
1 1 1    6   38    0 o 41.51671 2.038618   39.53207   180.0   17.41177 1.684040   17.41177 1.684040 
1 1 1    6   38    1 o 41.85282 1.329265   31.77189    54.8   17.56213 1.112669          ?        ? 
1 1 1    6   38    2 o 122.0127 1.121427   108.0071   357.3   149.1578 2.736565          ?        ? 
1 1 1    6   38    3 o 46.00432 1.438098   45.96064    62.4   21.23093 1.323174          ?        ? 
1 1 1    6   38    4 o 71.80577 1.109816   59.22145   214.1   51.66394 1.593824          ?        ? 
1 1 1    6   38    5 o 46.39614 1.458361   29.10512   220.9   21.62187 1.353247          ?        ? 
1 1 1    6   38    6 o 7.027430 3.269120   7.687496   305.9 -0.9623086 1.112669          ?        ? 
1 1 1    6   38    7 o 51.67169 1.367665   54.09277    39.5   26.82435 1.413391          ?        ? 
1 1 1    6   38    8 o 30.15339 2.044476   42.92458   126.8   9.202076 1.232958          ?        ? 
1 1 1    6   38    9 o 69.69319 1.337629   70.14364   108.9   48.86723 1.864473          ?        ? 
1 1 1    6   38   10 o 25.76851 2.217322   18.34856   315.3   6.766232 1.142741          ?        ? 
1 1 1    6   38   11 o 66.33820 1.291950   61.40276    18.4   44.38649 1.714112          ?        ? 
1 1 1    6   38   12 o 37.92266 2.061764   47.12127   228.8   14.76542 1.563751          ?        ? 
1 1 1    6   38   13 o 14.73270 4.378386   10.52213   300.7   2.526060 1.383319          ?        ? 
1 1 1    6   38   14 o 14.49378 4.562726   9.499812    71.9   2.556132 1.473535          ?        ? 
1 1 1    6   38   15 o 34.45590 1.963737   31.21041    50.5   12.41980 1.353247          ?        ? 
1 1 1    6   39    0 f 72.59601 1.575763   42.90211   360.0   52.89690 2.285483   52.89690 2.285483 
1 1 1    6   39    1 o 38.92847 1.467745   33.54539   210.0   15.21651 1.142741          ?        ? 
1 1 1    6   39    2 o 71.52346 1.051129   64.88967    45.0   51.27301 1.503607          ?        ? 
1 1 1    6   39    3 o 108.6623 1.106994   87.19143   148.4   118.3940 2.405771          ?        ? 
1 1 1    6   39    4 o 79.50053 1.059138   83.32717   167.3   63.36201 1.684040          ?        ? 
1 1 1    6   39    5 o 68.25946 1.233558   65.68895    23.5   46.76218 1.684040          ?        ? 
1 1 1    6   39    6 o 85.88670 1.155453   77.46492   325.8   74.03762 1.984761          ?        ? 
1 1 1    6   39    7 o 9.844817 3.996803   16.70551   354.7  0.4811543 1.232958          ?        ? 
1 1 1    6   39    8 o 57.97813 1.348570   45.28957   117.1   33.83116 1.563751          ?        ? 
1 1 1    6   39    9 o 16.59371 3.717392   20.44864   100.0   3.007215 1.202886          ?        ? 
1 1 1    6   39   10 o 66.21839 1.203460   67.25532   186.0   44.17598 1.593824          ?        ? 
1 1 1    6   39   11 o 10.29184 3.987767   9.610999    91.6  0.8720922 1.172814          ?        ? 
1 1 1    6   39   12 o 48.68760 1.791200   39.78454   142.4   24.20808 1.744184          ?        ? 
1 1 1    6   39   13 o 28.33896 2.705956   22.83074    41.6   8.540489 1.533679          ?        ? 
1 1 1    6   39   14 o 8.767115 3.883608   7.373314    76.6       0.03 1.353247          ?        ? 
1 1 1    6   40    0 o 17.59828 4.754317   32.06958   360.0   3.759018 1.443463   3.759018 1.443463 
1 1 1    6   40    1 o 46.60345 1.290555   37.83067   315.1   21.80231 1.202886          ?        ? 
1 1 1    6   40    2 o 62.30537 1.158378   57.53832   226.0   38.94343 1.443463          ?        ? 
1 1 1    6   40    3 o 97.36214 1.158259   88.61700   335.2   95.11819 2.255411          ?        ? 
1 1 1    6   40    4 o 88.32681 1.157579   67.53783   284.3   78.30786 2.044906          ?        ? 
1 1 1    6   40    5 o 20.63968 2.841163   21.77406   263.4   4.360461 1.172814          ?        ? 
1 1 1    6   40    6 o 31.38115 1.820745   34.62781   308.2   9.953879 1.142741          ?        ? 
1 1 1    6   40    7 f 24.03701 2.627261   26.80381    93.9   5.924213 1.263030          ?        ? 
1 1 1    6   40    8 o 35.78234 1.848921   35.43720    87.3   12.99117 1.323174          ?        ? 
1 1 1    6   40    9 o 31.87285 2.028533   30.76128    38.0   10.37489 1.293102          ?        ? 
1 1 1    6   40   10 o 25.39935 2.367946   17.59434   338.9   6.676016 1.202886          ?        ? 
1 1 1    6   40   11 o 41.53738 1.737547   39.17922   278.7   17.59221 1.443463          ?        ? 
1 1 1    6   40   12 o 23.82461 3.092464   18.37123   336.9   6.134717 1.473535          ?        ? 
1 1 1    6   40   13 o 16.17792 4.361542   19.63751     3.1   3.247792 1.443463          ?        ? 
1 1 1    6   40   14 o 20.18642 3.714428   23.13485    91.9   4.871688 1.443463          ?        ? 
1 1 1    6   41    0 f 30.38179 2.661900   26.76339   360.0   9.532870 1.593824   9.532870 1.593824 
1 1 1    6   41    1 o 7.531135 3.374885   7.128788   260.3 -0.4210100 1.052525          ?        ? 
1 1 1    6   41    2 o 38.72393 1.514327   44.25966   274.7   15.09622 1.172814          ?        ? 
1 1 1    6   41    3 o 11.05431 3.909384   15.44241   287.7   1.142741 1.082597          ?        ? 
1 1 1    6   41    4 o 46.26635 1.332456   38.24467   330.6   21.53165 1.232958          ?        ? 
1 1 1    6   41    5 o 55.75175 1.402424   43.65260   331.6   31.30510 1.563751          ?        ? 
1 1 1    6   41    6 o 33.28552 1.806920   33.30362   313.8   11.21691 1.202886          ?        ? 
1 1 1    6   41    7 o 25.57923 2.468859   21.15681    10.8   6.736160 1.263030          ?        ? 
1 1 1    6   41    8 o 15.87118 3.982133   14.94957   293.0   2.826782 1.263030          ?        ? 
1 1 1    6   41    9 o 13.23233 4.286078   15.54397   338.9   1.954689 1.293102          ?        ? 
1 1 1    6   41   10 o 21.71128 2.839440   13.69503   154.7   4.961904 1.232958          ?        ? 
1 1 1    6   41   11 o 51.53997 1.458681   46.18979   248.9   27.03486 1.503607          ?        ? 
1 1 1    6   41   12 o 11.06503 4.356782   7.217369    74.0   1.172814 1.413391          ?        ? 
1 1 1    6   41   13 o 30.13313 2.694535   33.29072    13.5   9.893736 1.623896          ?        ? 
1 1 1    6   42    0 o 18.05686 5.191217   12.75499   180.0   4.089812 1.623896   4.089812 1.623896 
1 1 1    6   42    1 o 27.16031 2.048337   17.84693   287.6   7.487964 1.112669          ?        ? 
1 1 1    6   42    2 o 9.051328 3.752493   8.380549    29.6  0.3007214 1.112669          ?        ? 
1 1 1    6   42    3 o 63.45279 1.113734   53.20686   167.3   40.44703 1.413391          ?        ? 
1 1 1    6   42    4 o 27.84072 2.052284   29.36783   338.4   7.878902 1.142741          ?        ? 
1 1 1    6   42    5 o 63.90928 1.105779   50.87151   250.4   41.07855 1.413391          ?        ? 
1 1 1    6   42    6 o 69.48680 1.363241   60.21660    93.3   48.74695 1.894545          ?        ? 
1 1 1    6   42    7 o 35.77111 1.891536   22.65616   129.3   13.05131 1.353247          ?        ? 
1 1 1    6   42    8 o 25.03045 2.583058   19.58239    48.1   6.525656 1.293102          ?        ? 
1 1 1    6   42    9 o 11.95809 4.223264   15.24012   358.6   1.503607 1.263030          ?        ? 
1 1 1    6   42   10 o 35.17448 2.051861   32.17738   168.0   12.81073 1.443463          ?        ? 
1 1 1    6   42   11 o 11.58582 4.209977   11.30115   142.8   1.473535 1.263030          ?        ? 
1 1 1    6   42   12 o 7.868725 3.690348   4.687574   275.3 -0.9021643 1.473535          ?        ? 
1 1 1    6   43    0 o 55.87397 1.725909   58.69366   180.0   31.51561 1.924617   31.51561 1.924617 
1 1 1    6   43    1 o 40.75111 1.512791   40.46276    18.9   16.78026 1.232958          ?        ? 
1 1 1    6   43    2 o 8.467929 3.587115   9.513251   147.9  0.1503607 1.052525          ?        ? 
1 1 1    6   43    3 o 21.78275 2.554016   22.43152   116.4   4.901759 1.112669          ?        ? 
1 1 1    6   43    4 o 30.60043 1.867198   30.19781    93.8   9.532870 1.142741          ?        ? 
1 1 1    6   43    5 o 15.35210 3.906863   11.08224    24.8   2.646349 1.202886          ?        ? 
1 1 1    6   43    6 o 49.93584 1.505539   48.93500    51.0   25.29067 1.503607          ?        ? 
1 1 1    6   43    7 f 13.12697 4.178579   14.65721   197.6   1.924617 1.232958          ?        ? 
1 1 1    6   43    8 o 22.45312 2.946527   11.33257   327.8   5.352841 1.323174          ?        ? 
1 1 1    6   43    9 o 45.80856 1.641186   40.38876   151.7   21.47151 1.503607          ?        ? 
1 1 1    6   43   10 o 8.799446 3.854480   5.091493    89.9       0.09 1.293102          ?        ? 
1 1 1    6   43   11 o 10.74115 4.182034   9.046177   111.2   1.202886 1.293102          ?        ? 
1 1 1    6   44    0 o 75.77280 1.608949   87.62949    -0.0   57.88888 2.435844   57.88888 2.435844 
1 1 1    6   44    1 o 15.17992 3.613088   6.673653   100.8   2.556132 1.082597          ?        ? 
1 1 1    6   44    2 o 50.27235 1.345915   36.26872    35.1   25.53125 1.353247          ?        ? 
1 1 1    6   44    3 o 22.70222 2.516806   14.62577    14.7   5.352841 1.142741          ?        ? 
1 1 1    6   44    4 o 40.09866 1.574903   35.18309   349.9   16.32917 1.263030          ?        ? 
1 1 1    6   44    5 o 33.34520 1.893871   18.04659    46.6   11.36727 1.263030          ?        ? 
1 1 1    6   44    6 o 56.71976 1.351980   43.22536    52.2   32.56813 1.533679          ?        ? 
1 1 1    6   44    7 o 30.53214 2.019114   20.61534   152.3   9.623086 1.232958          ?        ? 
1 1 1    6   44    8 o 27.39256 2.470099   12.36066   149.2   7.908974 1.353247          ?        ? 
1 1 1    6   44    9 o 13.70807 4.325213   12.11130   207.3   2.315555 1.323174          ?        ? 
1 1 1    6   44   10 o 19.23874 3.489134   19.08693   175.2   4.330389 1.293102          ?        ? 
1 1 1    6   45    0 o 23.95253 3.718665   21.09536   180.0   6.255006 1.684040   6.255006 1.684040 
1 1 1    6   45    1 o 27.43283 2.082799   17.86687   161.5   7.728541 1.142741          ?        ? 
1 1 1    6   45    2 o 8.604787 3.641187   10.66110   210.3  0.2105050 1.082597          ?        ? 
1 1 1    6   45    3 o 8.712052 3.661617   6.191787   316.4  0.2706493 1.082597          ?        ? 
1 1 1    6   45    4 o 30.82594 1.902316   25.66159   117.2   9.743376 1.172814          ?        ? 
1 1 1    6   45    5 o 31.67027 2.088985   23.41308    71.6   10.37489 1.323174          ?        ? 
1 1 1    6   45    6 o 18.72893 3.501716   11.57349   132.1   3.969523 1.263030          ?        ? 
1 1 1    6   45    7 o 16.26608 3.922293   13.26107   174.1   3.127503 1.263030          ?        ? 
1 1 1    6   45    8 o 49.91068 1.536424   39.94230   215.5   25.59139 1.533679          ?        ? 
1 1 1    6   45    9 o 24.25767 2.727332   23.57238    26.3   6.435439 1.323174          ?        ? 
1 1 1    6   46    0 o 9.810065 5.489449   14.35649   180.0   1.563751 1.593824   1.563751 1.593824 
1 1 1    6   46    1 o 9.279572 3.786921   13.18382   305.2  0.5412986 1.112669          ?        ? 
1 1 1    6   46    2 o 23.95845 2.133804   20.56262   169.4   5.954284 1.022453          ?        ? 
1 1 1    6   46    3 o 28.29393 2.072554   22.83280   273.7   8.299912 1.172814          ?        ? 
1 1 1    6   46    4 f 33.46284 1.797346   25.71512   161.4   11.51763 1.202886          ?        ? 
1 1 1    6   46    5 o 14.04397 4.245340   17.23087   253.0   2.375700 1.293102          ?        ? 
1 1 1    6   46    6 o 12.04338 4.180470   21.82810   185.8   1.714112 1.232958          ?        ? 
1 1 1    6   46    7 o 41.37371 1.780763   34.84876   151.0   17.77264 1.473535          ?        ? 
1 1 1    6   46    8 o 8.282286 3.683585   7.515391    31.7   0.000000 1.232958          ?        ? 
1 1 1    6   47    0 o 25.16918 3.474654   19.96417   180.0   6.856449 1.714112   6.856449 1.714112 
1 1 1    6   47    1 o 21.98470 2.598947   23.35603   341.0   5.142337 1.142741          ?        ? 
1 1 1    6   47    2 o 14.27446 3.967507   8.832842   161.3   2.435844 1.172814          ?        ? 
1 1 1    6   47    3 o 18.55836 3.364647   24.55219   217.4   3.939451 1.202886          ?        ? 
1 1 1    6   47    4 o 35.71983 1.725873   30.08928   236.2   13.20167 1.232958          ?        ? 
1 1 1    6   47    5 o 25.33214 2.611652   23.18095    91.8   6.946666 1.323174          ?        ? 
1 1 1    6   47    6 o 19.92782 3.244465   18.03264   110.6   4.510822 1.293102          ?        ? 
1 1 1    6   48    0 o 19.16220 5.270668   9.319253   360.0   4.871688 1.744184   4.871688 1.744184 
1 1 1    6   48    1 o 26.47547 2.214907   16.09991   236.6   7.427820 1.172814          ?        ? 
1 1 1    6   48    2 o 37.73900 1.673375   33.13398   113.8   14.73535 1.263030          ?        ? 
1 1 1    6   48    3 o 13.79168 4.011874   6.091008   112.9   2.375700 1.172814          ?        ? 
1 1 1    7    0    1 o 279.5818 2.528152   331.6224   270.0   781.9660 14.13391   781.9660 14.13391 
1 1 1    7    0    2 o 138.3259 1.391681   636.3380    90.0   191.4092 3.849235   191.4092 3.849235 
1 1 1    7    0    3 o 127.8461 1.235171   9.214891    90.0   163.5023 3.157575   163.5023 3.157575 
1 1 1    7    0    4 o 44.23128 0.6461987   39.64773   270.0   19.57697 0.5713707   19.57697 0.5713707 
1 1 1    7    0    5 o 319.9520 3.196361   648.2535   270.0   1024.408 20.44906   1024.408 20.44906 
1 1 1    7    0    6 o 159.1320 1.833614   344.1170    90.0   253.3578 5.833996   253.3578 5.833996 
1 1 1    7    0    7 o 115.8559 1.532034   169.9911    90.0   134.3022 3.548513   134.3022 3.548513 
1 1 1    7    0    8 o 96.01992 1.410020   106.0221   270.0   92.26134 2.706493   92.26134 2.706493 
1 1 1    7    0    9 o 301.9722 3.097851   276.6758   270.0   912.3588 18.70487   912.3588 18.70487 
1 1 1    7    0   10 o 19.54961 2.446785   40.20831   270.0   3.999595 0.9322364   3.999595 0.9322364 
1 1 1    7    0   11 o 41.39945 1.420120   62.65200    90.0   17.20127 1.172814   17.20127 1.172814 
1 1 1    7    0   12 o 245.4747 2.579392   271.3396    90.0   603.0668 12.66037   603.0668 12.66037 
1 1 1    7    0   13 o 11.80991 4.657341   16.39781    90.0   1.924617 1.052525   1.924617 1.052525 
1 1 1    7    0   14 o 56.29047 1.417708   104.0481    90.0   31.75618 1.593824   31.75618 1.593824 
1 1 1    7    0   15 o 172.1783 2.061616   196.7601    90.0   296.8421 7.097026   296.8421 7.097026 
1 1 1    7    0   16 o 115.5038 1.627951   135.0573   270.0   133.5805 3.759018   133.5805 3.759018 
1 1 1    7    0   17 o 95.65759 1.478342   101.9569   270.0   91.62983 2.826782   91.62983 2.826782 
1 1 1    7    0   18 o 9.747224 5.011760   43.77451    90.0   1.413391 1.232958   1.413391 1.232958 
1 1 1    7    0   19 o 102.2503 1.530104   108.5858    90.0   104.7713 3.127503   104.7713 3.127503 
1 1 1    7    0   20 o 71.86176 1.696914   71.24078    90.0   51.87445 2.435844   51.87445 2.435844 
1 1 1    7    0   21 o 24.51452 4.377787   1.941037   270.0   6.645944 1.954689   6.645944 1.954689 
1 1 1    7    0   22 o 87.30190 2.605802   80.33436   270.0   77.55606 4.540894   77.55606 4.540894 
1 1 1    7    0   23 x        ?      ?  0.7683461    90.0          ?        ?          ?        ? 
1 1 1    7    0   24 x        ?      ?   16.72842    90.0          ?        ?          ?        ? 
1 1 1    7    1    0 o 340.0652 2.980623   250.5332   180.0   1156.936 20.26863   1156.936 20.26863 
1 1 1    7    1    1 o 121.0644 0.9066521   184.0971   261.7   146.5716 2.195267          ?        ? 
1 1 1    7    1    2 o 280.3636 1.737632   526.0051   331.1   786.1761 9.743376          ?        ? 
1 1 1    7    1    3 o 279.3399 1.824741   577.3582   259.6   780.5225 10.19446          ?        ? 
1 1 1    7    1    4 o 294.4422 1.899666   406.7030   273.1   867.2505 11.18684          ?        ? 
1 1 1    7    1    5 o 296.0748 2.102487   226.5794   272.5   876.9037 12.44987          ?        ? 
1 1 1    7    1    6 o 70.82281 0.7218388   111.4956    35.1   50.16034 1.022453          ?        ? 
1 1 1    7    1    7 o 325.8510 2.302586   284.7887   182.2   1061.998 15.00600          ?        ? 
1 1 1    7    1    8 o 422.6750 2.941937   396.4706   101.4   1787.127 24.86966          ?        ? 
1 1 1    7    1    9 o 255.2261 1.920556   282.7968   276.8   651.5130 9.803518          ?        ? 
1 1 1    7    1   10 o 300.7964 2.164460   312.5402   311.6   905.0513 13.02124          ?        ? 
1 1 1    7    1   11 o 226.0036 1.723133   294.2494    83.7   510.9258 7.788685          ?        ? 
1 1 1    7    1   12 o 210.6108 1.649171   272.0914   108.3   443.7446 6.946666          ?        ? 
1 1 1    7    1   13 o 81.58939 0.9214478   88.82055   268.4   66.57973 1.503607          ?        ? 
1 1 1    7    1   14 o 119.1156 1.123456   132.2069   352.2   141.9405 2.676421          ?        ? 
1 1 1    7    1   15 o 60.16263 0.8747333   57.72965   188.5   36.20686 1.052525          ?        ? 
1 1 1    7    1   16 o 137.8210 1.200084   167.7765   211.3   190.0860 3.307936          ?        ? 
1 1 1    7    1   17 o 68.42755 1.010791   63.45406   340.1   46.85240 1.383319          ?        ? 
1 1 1    7    1   18 o 27.22141 1.712322   35.74774    45.2   7.427820 0.9322364          ?        ? 
1 1 1    7    1   19 o 97.19018 1.129367   96.88694   103.3   94.60697 2.195267          ?        ? 
1 1 1    7    1   20 f 34.36545 1.706385   41.23937   184.9   11.87850 1.172814          ?        ? 
1 1 1    7    1   21 o 28.61065 2.470043   42.23511   228.3   8.329985 1.413391          ?        ? 
1 1 1    7    1   22 o 51.14708 1.910852   52.40022   206.0   26.58378 1.954689          ?        ? 
1 1 1    7    1   23 x        ?      ?   49.19134   344.8          ?        ?          ?        ? 
1 1 1    7    1   24 o 18.56821 4.223891   13.51073   273.3   4.119884 1.533679          ?        ? 
1 1 1    7    2    0 o 98.71710 1.157950   60.42969   180.0   97.49390 2.285483   97.49390 2.285483 
1 1 1    7    2    1 o 90.20696 0.7500787   130.5290   157.1   81.37523 1.353247          ?        ? 
1 1 1    7    2    2 o 146.1363 1.028907   299.9076   346.0   213.5724 3.007215          ?        ? 
1 1 1    7    2    3 o 318.8696 2.253976   491.3681    27.6   1017.220 14.37449          ?        ? 
1 1 1    7    2    4 o 86.07762 0.7860617   235.3329    55.2   74.09776 1.353247          ?        ? 
1 1 1    7    2    5 o 180.4143 1.233461   101.4189   359.9   325.5310 4.450677          ?        ? 
1 1 1    7    2    6 o 281.2519 2.047565   277.1212   137.0   791.2282 11.51763          ?        ? 
1 1 1    7    2    7 o 275.2324 1.988549   343.5236    74.5   757.6376 10.94626          ?        ? 
1 1 1    7    2    8 o 96.06587 1.173888   115.7253    74.7   92.29141 2.255411          ?        ? 
1 1 1    7    2    9 o 27.69088 1.248894   99.93548   246.2   7.668397 0.6916593          ?        ? 
1 1 1    7    2   10 o 301.6978 2.192880   375.6164   145.2   910.4943 13.23174          ?        ? 
1 1 1    7    2   11 o 404.9168 2.803597   461.9530   122.5   1640.856 22.70447          ?        ? 
1 1 1    7    2   12 o 176.1548 1.468143   240.0488   226.2   310.4047 5.172409          ?        ? 
1 1 1    7    2   13 o 84.51996 1.014028   114.8886   145.1   71.45142 1.714112          ?        ? 
1 1 1    7    2   14 o 113.8273 1.043554   138.3094   118.7   129.6109 2.375700          ?        ? 
1 1 1    7    2   15 o 60.53535 0.9190245   68.12100   108.1   36.65794 1.112669          ?        ? 
1 1 1    7    2   16 o 103.1151 1.108220   110.8116   114.2   106.3952 2.285483          ?        ? 
1 1 1    7    2   17 o 33.83161 1.288872   48.81620   143.6   11.45749 0.8720922          ?        ? 
1 1 1    7    2   18 o 67.44073 1.114762   75.78524   203.4   45.52922 1.503607          ?        ? 
1 1 1    7    2   19 o 30.97256 1.602032   38.86222   259.3   9.623086 0.9923807          ?        ? 
1 1 1    7    2   20 o 16.18073 3.273895   18.65528    34.9   2.766637 1.022453          ?        ? 
1 1 1    7    2   21 o 20.23631 2.674889   31.38778     1.0   4.180028 1.082597          ?        ? 
1 1 1    7    2   22 o 21.61070 2.852656   24.45348     6.9   4.841615 1.232958          ?        ? 
1 1 1    7    2   23 o 30.57839 2.606128   27.81062   283.1   9.743376 1.593824          ?        ? 
1 1 1    7    2   24 o 12.75751 4.336614   13.40806   256.3   1.894545 1.323174          ?        ? 
1 1 1    7    3    0 o 743.6818 8.832181   1072.428     0.0   5543.860 131.3251   5543.860 131.3251 
1 1 1    7    3    1 o 203.1920 1.502187   400.4815   345.8   412.9206 6.104645          ?        ? 
1 1 1    7    3    2 o 209.5056 1.485624   451.8912    71.4   438.9932 6.224934          ?        ? 
1 1 1    7    3    3 o 48.86348 0.6462035   50.70360   210.1   23.87728 0.6315150          ?        ? 
1 1 1    7    3    4 o 241.5392 1.792830   283.6982    41.7   583.5800 8.660777          ?        ? 
1 1 1    7    3    5 o 310.1992 1.987365   369.7527     0.0   962.5191 12.32958          ?        ? 
1 1 1    7    3    6 o 258.8659 1.847084   313.7787    29.4   670.2480 9.562942          ?        ? 
1 1 1    7    3    7 o 278.4039 2.019904   315.8278   270.0   775.1998 11.24698          ?        ? 
1 1 1    7    3    8 o 396.6471 2.763488   482.7831    65.1   1573.766 21.92259          ?        ? 
1 1 1    7    3    9 o 166.8375 1.523097   152.3993   113.3   278.3778 5.082192          ?        ? 
1 1 1    7    3   10 o 348.3634 2.736473   469.8995    58.2   1214.163 19.06574          ?        ? 
1 1 1    7    3   11 o 91.70803 0.9837354   71.24734    93.5   84.11179 1.804329          ?        ? 
1 1 1    7    3   12 o 38.77285 1.085837   89.01112   279.1   15.03607 0.8420200          ?        ? 
1 1 1    7    3   13 o 70.39142 0.9398692   37.47225   298.3   49.55890 1.323174          ?        ? 
1 1 1    7    3   14 o 30.62225 1.325748   25.85105   101.8   9.382509 0.8119479          ?        ? 
1 1 1    7    3   15 o 170.4102 1.464694   181.8345   232.4   290.6473 4.991976          ?        ? 
1 1 1    7    3   16 o 65.21624 0.9452844   80.26119   113.9   42.55209 1.232958          ?        ? 
1 1 1    7    3   17 o 81.01424 1.039348   89.91899    82.8   65.67756 1.684040          ?        ? 
1 1 1    7    3   18 o 53.78429 1.146206   59.10481   326.5   28.95948 1.232958          ?        ? 
1 1 1    7    3   19 o 73.75307 1.202836   77.44392    15.2   54.49073 1.774257          ?        ? 
1 1 1    7    3   20 o 45.28531 1.460931   53.19901   323.5   20.59942 1.323174          ?        ? 
1 1 1    7    3   21 o 59.16003 1.347044   63.25031   175.2   35.18441 1.593824          ?        ? 
1 1 1    7    3   22 o 28.16055 2.082371   23.90921   270.8   8.089407 1.172814          ?        ? 
1 1 1    7    3   23 o 18.67395 2.898683   23.40309    75.6   3.668802 1.082597          ?        ? 
1 1 1    7    3   24 o 27.60201 2.505829   17.02833   224.9   8.059335 1.383319          ?        ? 
1 1 1    7    4    0 o 397.5959 4.036058   676.6349   180.0   1582.065 32.08698   1582.065 32.08698 
1 1 1    7    4    1 o 369.0721 2.652187   299.6310   123.1   1362.749 19.57697          ?        ? 
1 1 1    7    4    2 o 100.8737 1.073221   151.0226   257.1   101.7641 2.165194          ?        ? 
1 1 1    7    4    3 o 82.07142 0.8427530   159.3166   236.6   67.36160 1.383319          ?        ? 
1 1 1    7    4    4 o 319.5451 2.282149   327.8665    21.9   1021.551 14.58499          ?        ? 
1 1 1    7    4    5 o 343.3538 2.220243   543.5356   298.2   1179.339 15.24658          ?        ? 
1 1 1    7    4    6 o 198.4910 1.522614   161.4026    54.2   394.0353 6.044501          ?        ? 
1 1 1    7    4    7 o 347.6138 2.266568   424.9464     9.6   1208.569 15.75780          ?        ? 
1 1 1    7    4    8 o 36.12613 0.7907997   123.9973   194.1   13.05131 0.5713707          ?        ? 
1 1 1    7    4    9 f 259.5445 1.772736   300.4634     0.5   673.7363 9.202076          ?        ? 
1 1 1    7    4   10 o 57.53907 0.9407496   139.9410   330.5   33.10943 1.082597          ?        ? 
1 1 1    7    4   11 o 111.0287 1.327166   123.7207   249.2   123.2958 2.947070          ?        ? 
1 1 1    7    4   12 o 53.07813 1.019815   82.62386    74.9   28.17760 1.082597          ?        ? 
1 1 1    7    4   13 o 117.9019 1.198786   113.9633   128.0   139.0536 2.826782          ?        ? 
1 1 1    7    4   14 o 160.9890 1.410312   185.5399    77.4   259.3422 4.540894          ?        ? 
1 1 1    7    4   15 o 71.38099 0.9900330   83.47466    43.6   50.97229 1.413391          ?        ? 
1 1 1    7    4   16 o 104.6006 1.135605   109.7975   343.4   109.4927 2.375700          ?        ? 
1 1 1    7    4   17 o 137.3696 1.313485   137.1043   269.6   188.9132 3.608657          ?        ? 
1 1 1    7    4   18 o 50.84715 1.301130   52.26412    61.2   25.89212 1.323174          ?        ? 
1 1 1    7    4   19 o 94.25208 1.180525   96.78317   180.4   88.98347 2.225339          ?        ? 
1 1 1    7    4   20 o 75.40065 1.156611   83.39458   150.2   57.01679 1.744184          ?        ? 
1 1 1    7    4   21 o 9.709947 3.731503   14.67504   175.0  0.6916593 1.022453          ?        ? 
1 1 1    7    4   22 o 43.50155 1.797351   44.60078   302.1   19.21610 1.563751          ?        ? 
1 1 1    7    4   23 o 43.60229 1.655260   44.50731   262.5   19.33639 1.443463          ?        ? 
1 1 1    7    4   24 o 31.02002 2.084303   34.54628   288.7   10.01402 1.293102          ?        ? 
1 1 1    7    5    0 o 32.06924 1.412487   168.2730     0.0   10.34482 0.9021643   10.34482 0.9021643 
1 1 1    7    5    1 o 140.8283 1.409348   117.5448   150.1   198.3559 3.969523          ?        ? 
1 1 1    7    5    2 o 245.4027 1.850385   189.2995   135.2   602.4052 9.081788          ?        ? 
1 1 1    7    5    3 o 214.9440 1.804799   262.3680   260.4   462.1487 7.758613          ?        ? 
1 1 1    7    5    4 o 157.2421 1.262233   123.7125   334.2   247.2832 3.969523          ?        ? 
1 1 1    7    5    5 o 202.5798 1.551260   292.7486   224.8   410.4547 6.285078          ?        ? 
1 1 1    7    5    6 o 381.3899 2.397004   562.4391    33.1   1454.980 18.28386          ?        ? 
1 1 1    7    5    7 o 271.3343 1.922911   363.4427   299.3   736.3165 10.43503          ?        ? 
1 1 1    7    5    8 o 289.7226 2.127825   330.5270   274.0   839.5541 12.32958          ?        ? 
1 1 1    7    5    9 o 112.3412 1.057358   88.01048   198.2   126.2128 2.375700          ?        ? 
1 1 1    7    5   10 o 385.8772 2.712030   406.7132   134.8   1489.804 20.93021          ?        ? 
1 1 1    7    5   11 o 82.45348 1.021206   163.0087   114.7   67.99312 1.684040          ?        ? 
1 1 1    7    5   12 o 156.4174 1.499594   178.2965    83.6   244.7572 4.691255          ?        ? 
1 1 1    7    5   13 f 160.3708 1.331366   193.7561    38.1   257.2973 4.270245          ?        ? 
1 1 1    7    5   14 o 91.66380 1.033421   137.7833   275.0   84.05164 1.894545          ?        ? 
1 1 1    7    5   15 o 18.08384 2.411248   24.78538    94.3   3.277864 0.8720922          ?        ? 
1 1 1    7    5   16 o 74.96397 1.083118   94.86763   142.2   56.23491 1.623896          ?        ? 
1 1 1    7    5   17 o 128.4877 1.310663   125.7240   217.0   165.2765 3.368080          ?        ? 
1 1 1    7    5   18 o 112.9455 1.451082   129.8022    89.7   127.8066 3.277864          ?        ? 
1 1 1    7    5   19 o 95.70213 1.319751   100.6174   195.3   91.78019 2.526060          ?        ? 
1 1 1    7    5   20 o 50.66650 1.335445   55.55858   222.8   25.77183 1.353247          ?        ? 
1 1 1    7    5   21 o 22.65906 2.521600   26.04900   225.7   5.232553 1.142741          ?        ? 
1 1 1    7    5   22 o 49.05945 1.563083   44.63802    82.5   24.35844 1.533679          ?        ? 
1 1 1    7    5   23 o 72.85683 1.609751   64.73712   208.6   53.94942 2.345627          ?        ? 
1 1 1    7    5   24 o 26.10511 2.476722   30.47760    19.0   7.217315 1.293102          ?        ? 
1 1 1    7    6    0 o 215.9905 3.085333   214.8061   180.0   466.9904 13.32196   466.9904 13.32196 
1 1 1    7    6    1 o 286.2103 2.679287   445.8347   195.6   819.6765 15.33679          ?        ? 
1 1 1    7    6    2 o 201.0198 1.712896   229.0518   102.7   404.1997 6.886521          ?        ? 
1 1 1    7    6    3 o 221.2828 1.685150   267.6700    54.6   489.7850 7.457891          ?        ? 
1 1 1    7    6    4 o 299.4094 1.943480   335.7072    79.2   896.7213 11.63792          ?        ? 
1 1 1    7    6    5 o 102.1644 0.8388993   150.5039   299.6   104.3804 1.714112          ?        ? 
1 1 1    7    6    6 o 132.7801 1.007840   133.9211   285.6   176.3130 2.676421          ?        ? 
1 1 1    7    6    7 o 394.7204 2.674127   464.0349    96.5   1558.429 21.11065          ?        ? 
1 1 1    7    6    8 o 64.88435 0.8110778   50.46405   180.8   42.10100 1.052525          ?        ? 
1 1 1    7    6    9 o 163.9200 1.357576   168.4866    34.6   268.7247 4.450677          ?        ? 
1 1 1    7    6   10 o 126.0734 1.144939   139.5174   186.4   158.9613 2.886926          ?        ? 
1 1 1    7    6   11 o 79.00871 0.9515453   90.56293    70.7   62.42978 1.503607          ?        ? 
1 1 1    7    6   12 o 245.5460 1.959528   265.9745    30.6   603.3375 9.623086          ?        ? 
1 1 1    7    6   13 o 93.62994 1.059897   120.3047   221.6   87.69038 1.984761          ?        ? 
1 1 1    7    6   14 o 18.66596 1.933283   27.75322   167.6   3.488369 0.7217315          ?        ? 
1 1 1    7    6   15 o 32.43116 1.298165   48.23147   151.5   10.52525 0.8420200          ?        ? 
1 1 1    7    6   16 o 92.54142 1.137356   98.77610   261.9   85.70561 2.105050          ?        ? 
1 1 1    7    6   17 o 131.0376 1.273683   129.9787   309.8   171.8924 3.338008          ?        ? 
1 1 1    7    6   18 o 43.86658 1.371073   33.86833    24.1   19.27625 1.202886          ?        ? 
1 1 1    7    6   19 o 62.67880 1.271422   74.65154   110.2   39.36444 1.593824          ?        ? 
1 1 1    7    6   20 o 56.82168 1.349555   63.64415   129.5   32.41777 1.533679          ?        ? 
1 1 1    7    6   21 o 28.42578 2.274524   34.29649    21.0   8.209695 1.293102          ?        ? 
1 1 1    7    6   22 o 30.21581 2.040253   35.34699    75.6   9.322365 1.232958          ?        ? 
1 1 1    7    6   23 o 29.08725 2.843115   27.94394    74.5   8.901355 1.653968          ?        ? 
1 1 1    7    6   24 o 11.01865 4.280627   14.62552   333.7   1.202886 1.353247          ?        ? 
1 1 1    7    7    0 o 4.205193 2.813835   24.60336   180.0 -0.1804329 0.6315150 -0.1804329 0.6315150 
1 1 1    7    7    1 o 219.6490 1.950967   220.2821   230.5   482.6279 8.570561          ?        ? 
1 1 1    7    7    2 o 91.93754 0.9976344   193.9959   229.3   84.53280 1.834401          ?        ? 
1 1 1    7    7    3 o 209.8294 1.590820   272.4550    28.4   440.3765 6.676016          ?        ? 
1 1 1    7    7    4 o 88.52329 0.8662575   263.6413   231.3   78.36801 1.533679          ?        ? 
1 1 1    7    7    5 o 281.4457 1.875197   270.1238   159.7   792.2808 10.55532          ?        ? 
1 1 1    7    7    6 o 158.6382 1.175299   175.0943    20.4   251.6738 3.728946          ?        ? 
1 1 1    7    7    7 o 184.3993 1.418811   197.1978    52.6   340.0558 5.232553          ?        ? 
1 1 1    7    7    8 o 360.2027 2.512950   398.0973   172.7   1297.824 18.10343          ?        ? 
1 1 1    7    7    9 o 92.78586 0.9398979   84.84785   307.6   86.09655 1.744184          ?        ? 
1 1 1    7    7   10 o 257.4411 1.915712   304.1502   156.9   662.9705 9.863664          ?        ? 
1 1 1    7    7   11 o 141.3064 1.234328   225.1081   260.7   199.7091 3.488369          ?        ? 
1 1 1    7    7   12 o 48.27184 0.9967598   53.80544   114.9   23.30591 0.9623086          ?        ? 
1 1 1    7    7   13 o 212.2460 1.771067   256.7560   116.6   450.8416 7.518036          ?        ? 
1 1 1    7    7   14 o 189.5269 1.697764   244.3483   131.3   359.5425 6.435439          ?        ? 
1 1 1    7    7   15 f 122.6114 1.115950   152.5676    82.1   150.4209 2.736565          ?        ? 
1 1 1    7    7   16 o 40.01960 1.164725   44.61847   144.3   16.02845 0.9322364          ?        ? 
1 1 1    7    7   17 o 15.45935 3.218637   22.02490    43.3   2.495988 0.9623086          ?        ? 
1 1 1    7    7   18 f 8.057010 3.528058   23.60747    35.4 -0.2405772 1.082597          ?        ? 
1 1 1    7    7   19 o 75.53528 1.214268   92.22831    16.5   57.16715 1.834401          ?        ? 
1 1 1    7    7   20 o 52.39742 1.406114   57.14883   166.2   27.57616 1.473535          ?        ? 
1 1 1    7    7   21 o 51.62303 1.427207   51.11157   336.3   26.82435 1.473535          ?        ? 
1 1 1    7    7   22 o 32.48627 2.360504   33.88902    78.2   10.85604 1.533679          ?        ? 
1 1 1    7    7   23 o 13.89045 3.934474   22.67211   100.7   2.195267 1.142741          ?        ? 
1 1 1    7    7   24 o 9.305226 3.960220   3.938503   154.0  0.4210100 1.293102          ?        ? 
1 1 1    7    8    0 o 48.49036 1.429123   70.37667   180.0   23.57656 1.383319   23.57656 1.383319 
1 1 1    7    8    1 o 104.9482 1.146171   124.5753   312.1   110.1543 2.405771          ?        ? 
1 1 1    7    8    2 o 196.8955 1.756412   231.6743   173.9   387.7803 6.916593          ?        ? 
1 1 1    7    8    3 o 145.9370 1.236375   264.7174   220.9   213.0010 3.608657          ?        ? 
1 1 1    7    8    4 o 226.3333 1.707337   320.1292   170.5   512.3692 7.728541          ?        ? 
1 1 1    7    8    5 o 375.0711 2.617785   440.1460    57.4   1407.256 19.63711          ?        ? 
1 1 1    7    8    6 o 323.6315 2.281209   394.3609   241.6   1047.563 14.76542          ?        ? 
1 1 1    7    8    7 o 120.4044 0.9990383   185.5208   258.0   144.9778 2.405771          ?        ? 
1 1 1    7    8    8 o 240.2952 1.827142   233.3435    65.0   577.5055 8.781067          ?        ? 
1 1 1    7    8    9 o 196.9452 1.549834   328.6112   201.8   387.9307 6.104645          ?        ? 
1 1 1    7    8   10 o 90.70294 0.9614817   126.6775    31.5   82.27739 1.744184          ?        ? 
1 1 1    7    8   11 o 306.0262 2.269958   374.7108   316.3   937.1082 13.89333          ?        ? 
1 1 1    7    8   12 o 175.6902 1.395001   190.5784    19.9   308.7808 4.901759          ?        ? 
1 1 1    7    8   13 o 203.5157 1.595843   245.4651    60.7   414.4543 6.495584          ?        ? 
1 1 1    7    8   14 o 151.5729 1.249923   191.7651   335.2   229.8715 3.789090          ?        ? 
1 1 1    7    8   15 o 126.1098 1.168454   141.6828   251.4   159.1418 2.947070          ?        ? 
1 1 1    7    8   16 o 71.69042 0.9857598   95.21086    57.7   51.42337 1.413391          ?        ? 
1 1 1    7    8   17 o 51.03772 1.178428   33.52021    44.4   26.07255 1.202886          ?        ? 
1 1 1    7    8   18 o 113.8288 1.136006   133.8557   330.7   129.7312 2.586205          ?        ? 
1 1 1    7    8   19 o 40.96929 1.504734   54.63682    20.0   16.84040 1.232958          ?        ? 
1 1 1    7    8   20 o 84.55406 1.333709   92.99494   268.0   71.78221 2.255411          ?        ? 
1 1 1    7    8   21 o 19.95599 3.828535   23.52457   248.0   4.300317 1.473535          ?        ? 
1 1 1    7    8   22 o 22.38657 3.291114   22.78973     3.8   5.292697 1.473535          ?        ? 
1 1 1    7    8   23 o 15.79479 3.917208   13.86372   139.9   2.856854 1.232958          ?        ? 
1 1 1    7    8   24 o 11.37037 4.518911   15.82678   227.5   1.323174 1.533679          ?        ? 
1 1 1    7    9    0 o 99.68794 1.448667   29.08620     0.0   99.44859 2.886926   99.44859 2.886926 
1 1 1    7    9    1 o 189.3392 1.715330   396.8802   142.8   358.5803 6.495584          ?        ? 
1 1 1    7    9    2 o 162.3497 1.370707   212.6312   206.4   263.6124 4.450677          ?        ? 
1 1 1    7    9    3 o 257.6233 1.926031   357.3415   140.2   663.8727 9.923808          ?        ? 
1 1 1    7    9    4 o 177.3967 1.440913   175.1406   120.3   314.7350 5.112265          ?        ? 
1 1 1    7    9    5 o 324.3360 2.304070   442.5034   167.3   1052.164 14.94586          ?        ? 
1 1 1    7    9    6 o 268.9345 1.979207   293.8232   165.7   723.3553 10.64554          ?        ? 
1 1 1    7    9    7 o 127.2161 1.134654   220.4676   216.5   161.8483 2.886926          ?        ? 
1 1 1    7    9    8 o 391.2174 2.717288   426.1098   167.2   1531.063 21.26101          ?        ? 
1 1 1    7    9    9 o 219.7223 1.683431   261.5755   102.8   482.8684 7.397748          ?        ? 
1 1 1    7    9   10 o 180.3229 1.442546   125.3769   303.0   325.2303 5.202481          ?        ? 
1 1 1    7    9   11 o 11.20067 3.112108   39.96344    80.8   1.293102 0.7217315          ?        ? 
1 1 1    7    9   12 o 82.39675 0.9124190   89.50765   206.3   67.90290 1.503607          ?        ? 
1 1 1    7    9   13 o 212.0224 1.687834   275.4314   272.5   449.8793 7.157170          ?        ? 
1 1 1    7    9   14 f 141.4546 1.243664   200.7762   231.0   200.2203 3.518441          ?        ? 
1 1 1    7    9   15 o 63.46537 0.9713628   77.49822   242.0   40.29667 1.232958          ?        ? 
1 1 1    7    9   16 o 154.8326 1.359566   179.9264   243.0   239.9757 4.210100          ?        ? 
1 1 1    7    9   17 o 24.79269 2.062005   25.19010    61.2   6.164790 1.022453          ?        ? 
1 1 1    7    9   18 o 58.04488 1.217498   59.18128   266.9   33.74094 1.413391          ?        ? 
1 1 1    7    9   19 o 117.3617 1.345233   129.0949    71.3   138.1214 3.157575          ?        ? 
1 1 1    7    9   20 o 19.01252 4.292836   19.09303   139.6   3.909379 1.593824          ?        ? 
1 1 1    7    9   21 o 32.04939 2.111189   40.09269   335.7   10.43503 1.353247          ?        ? 
1 1 1    7    9   22 o 23.21000 3.239137   17.00827   307.4   5.683635 1.503607          ?        ? 
1 1 1    7    9   23 o 25.12543 2.812669   29.87285   168.6   6.676016 1.413391          ?        ? 
1 1 1    7    9   24 o 18.85682 4.101373   15.37931   153.0   4.360461 1.503607          ?        ? 
1 1 1    7   10    0 o 13.65701 1.921457   242.1238    -0.0   1.924617 0.5112265   1.924617 0.5112265 
1 1 1    7   10    1 o 242.0556 2.124444   441.2539   133.8   586.1061 10.28467          ?        ? 
1 1 1    7   10    2 o 86.58263 0.9030399   244.2648   185.5   74.96986 1.563751          ?        ? 
1 1 1    7   10    3 o 110.4649 1.007261   175.0089   125.2   122.0328 2.225339          ?        ? 
1 1 1    7   10    4 o 356.8186 2.532570   409.3922   143.1   1273.585 18.07336          ?        ? 
1 1 1    7   10    5 o 198.5171 1.583007   251.9173   237.1   394.1255 6.285078          ?        ? 
1 1 1    7   10    6 o 241.6583 1.854167   330.0694   171.7   584.0612 8.961499          ?        ? 
1 1 1    7   10    7 o 189.8364 1.504903   195.1295    89.7   360.4146 5.713707          ?        ? 
1 1 1    7   10    8 o 487.4103 3.618576   499.3964   326.2   2377.384 35.27463          ?        ? 
1 1 1    7   10    9 o 288.4984 2.069101   292.6988   330.2   832.5775 11.93864          ?        ? 
1 1 1    7   10   10 o 186.8632 1.488615   221.6259   313.9   349.2579 5.563347          ?        ? 
1 1 1    7   10   11 o 78.01048 1.002270   124.9762    15.7   60.86602 1.563751          ?        ? 
1 1 1    7   10   12 o 115.6009 1.118592   109.3328   138.6   133.6707 2.586205          ?        ? 
1 1 1    7   10   13 o 41.75500 1.152327   57.59019   179.1   17.44184 0.9623086          ?        ? 
1 1 1    7   10   14 o 89.18372 0.9947200   111.1968   125.8   79.57090 1.774257          ?        ? 
1 1 1    7   10   15 o 142.8711 1.283955   148.2805   286.3   204.2801 3.668802          ?        ? 
1 1 1    7   10   16 o 44.80156 1.208214   61.01322   248.2   20.08819 1.082597          ?        ? 
1 1 1    7   10   17 o 51.74131 1.075223   63.83221   316.3   26.79428 1.112669          ?        ? 
1 1 1    7   10   18 o 16.24369 3.354167   21.59824   224.3   2.766637 1.052525          ?        ? 
1 1 1    7   10   19 o 20.85245 2.523745   25.59375    84.4   4.390533 1.052525          ?        ? 
1 1 1    7   10   20 o 78.48324 1.226133   81.93974   100.0   61.82833 1.924617          ?        ? 
1 1 1    7   10   21 o 31.00095 1.940079   35.47841    82.0   9.743376 1.202886          ?        ? 
1 1 1    7   10   22 o 55.64812 1.405035   53.33847   135.2   31.30510 1.563751          ?        ? 
1 1 1    7   10   23 o 24.30982 2.968889   25.69968    62.4   6.315150 1.443463          ?        ? 
1 1 1    7   10   24 o 21.90687 3.500453   19.97430   308.2   5.503202 1.533679          ?        ? 
1 1 1    7   11    0 o 258.8933 2.881482   449.4889   180.0   670.6990 14.91578   670.6990 14.91578 
1 1 1    7   11    1 o 369.4061 2.495117   445.4882    10.6   1365.185 18.43423          ?        ? 
1 1 1    7   11    2 o 433.2437 3.043699   669.3940   342.4   1878.096 26.37327          ?        ? 
1 1 1    7   11    3 o 171.9587 1.442760   165.5168   134.7   295.7295 4.961904          ?        ? 
1 1 1    7   11    4 o 208.2873 1.645911   269.0705   264.3   433.8809 6.856449          ?        ? 
1 1 1    7   11    5 o 428.0520 2.957672   493.6841   215.1   1832.837 25.32075          ?        ? 
1 1 1    7   11    6 o 437.4886 3.051973   524.9615   326.3   1914.693 26.70407          ?        ? 
1 1 1    7   11    7 o 301.5419 2.179055   396.7027   262.0   909.4719 13.14153          ?        ? 
1 1 1    7   11    8 o 306.0738 2.529971   327.6562    16.0   937.1683 15.48715          ?        ? 
1 1 1    7   11    9 o 243.5708 2.000112   239.2194   323.1   593.4738 9.743376          ?        ? 
1 1 1    7   11   10 o 312.5783 2.241617   339.7650   260.0   977.5853 14.01362          ?        ? 
1 1 1    7   11   11 o 124.8182 1.180546   164.0309   344.7   155.8339 2.947070          ?        ? 
1 1 1    7   11   12 o 188.4906 1.507671   198.1890    10.7   355.4828 5.683635          ?        ? 
1 1 1    7   11   13 o 143.4770 1.268054   147.0670   252.0   205.9641 3.638730          ?        ? 
1 1 1    7   11   14 o 140.2400 1.232992   158.5434   230.0   196.7921 3.458297          ?        ? 
1 1 1    7   11   15 o 170.4393 1.411512   191.1942   264.5   290.7976 4.811543          ?        ? 
1 1 1    7   11   16 o 69.01774 1.023933   54.74073   207.7   47.66435 1.413391          ?        ? 
1 1 1    7   11   17 o 51.85188 1.159925   47.87577    68.2   26.91457 1.202886          ?        ? 
1 1 1    7   11   18 o 60.58144 1.042423   55.46416   301.0   36.74816 1.263030          ?        ? 
1 1 1    7   11   19 o 56.40735 1.066249   50.90331    49.0   31.87647 1.202886          ?        ? 
1 1 1    7   11   20 o 12.56686 3.391108   9.612975    65.7   1.684040 0.8720922          ?        ? 
1 1 1    7   11   21 o 14.27436 3.234392   9.709292   101.9   2.195267 0.9021643          ?        ? 
1 1 1    7   11   22 o 41.67141 1.371134   36.50067   206.4   17.56213 1.142741          ?        ? 
1 1 1    7   11   23 o 24.67531 2.498363   24.67589   284.7   6.405366 1.232958          ?        ? 
1 1 1    7   11   24 o 8.781448 3.804759   5.599025    66.4  0.2706493 1.232958          ?        ? 
1 1 1    7   12    0 o 403.3292 4.146509   596.4000   180.0   1628.076 33.44022   1628.076 33.44022 
1 1 1    7   12    1 o 312.7079 2.197413   368.6329   261.1   978.1266 13.74297          ?        ? 
1 1 1    7   12    2 f 363.9450 2.458191   412.4617   118.7   1324.949 17.89293          ?        ? 
1 1 1    7   12    3 o 331.8332 2.446856   453.8016    61.9   1101.392 16.23896          ?        ? 
1 1 1    7   12    4 o 223.2272 1.737829   204.2212   185.6   498.3556 7.758613          ?        ? 
1 1 1    7   12    5 o 355.0573 2.523958   371.5050   202.3   1260.955 17.92300          ?        ? 
1 1 1    7   12    6 o 293.7407 2.144788   293.7316   321.7   863.0104 12.60023          ?        ? 
1 1 1    7   12    7 o 163.5341 1.425141   254.3147     8.1   267.4617 4.661182          ?        ? 
1 1 1    7   12    8 o 400.8129 2.798541   535.6583   350.2   1607.326 22.43382          ?        ? 
1 1 1    7   12    9 o 142.8282 1.431724   233.5798   144.8   204.0395 4.089812          ?        ? 
1 1 1    7   12   10 o 155.1710 1.511640   144.2323   207.6   240.8478 4.691255          ?        ? 
1 1 1    7   12   11 o 26.35081 1.540651   49.03677   143.8   6.946666 0.8119479          ?        ? 
1 1 1    7   12   12 o 70.53957 0.9378951   112.3816    63.2   49.76940 1.323174          ?        ? 
1 1 1    7   12   13 o 116.7817 1.145908   133.2942   247.4   136.4373 2.676421          ?        ? 
1 1 1    7   12   14 o 93.22141 1.000024   110.5643   171.6   86.93858 1.864473          ?        ? 
1 1 1    7   12   15 o 136.6810 1.243096   146.1320    80.7   186.9886 3.398152          ?        ? 
1 1 1    7   12   16 o 73.44272 1.085080   112.2402    52.8   53.97950 1.593824          ?        ? 
1 1 1    7   12   17 o 59.05634 1.120265   66.79134   341.4   34.91376 1.323174          ?        ? 
1 1 1    7   12   18 o 114.8399 1.099818   116.3749    13.7   132.0769 2.526060          ?        ? 
1 1 1    7   12   19 o 57.08307 1.079968   60.16083   332.3   32.65835 1.232958          ?        ? 
1 1 1    7   12   20 o 40.46596 1.263350   43.85479   261.6   16.44946 1.022453          ?        ? 
1 1 1    7   12   21 o 38.80489 1.278680   43.51572   199.2   15.15636 0.9923807          ?        ? 
1 1 1    7   12   22 o 20.23521 2.377807   13.96877    74.8   4.240172 0.9623086          ?        ? 
1 1 1    7   12   23 o 36.31559 1.656157   40.62377   256.8   13.50239 1.202886          ?        ? 
1 1 1    7   12   24 o 13.33879 4.227525   16.14011   168.0   2.255411 1.263030          ?        ? 
1 1 1    7   13    0 o 155.8594 2.074973   86.20678   180.0   243.0731 6.465511   243.0731 6.465511 
1 1 1    7   13    1 o 494.2878 3.236653   513.9908   248.5   2444.264 31.99676          ?        ? 
1 1 1    7   13    2 o 241.1117 1.746120   193.8901   193.6   581.4149 8.420200          ?        ? 
1 1 1    7   13    3 o 287.8839 2.188422   278.0149    40.0   828.9086 12.60023          ?        ? 
1 1 1    7   13    4 o 167.5238 1.445053   158.2289   184.8   280.6633 4.841615          ?        ? 
1 1 1    7   13    5 o 496.1650 3.400174   543.1661   277.8   2462.999 33.74094          ?        ? 
1 1 1    7   13    6 o 298.3643 2.187144   305.3724   148.2   890.4061 13.05131          ?        ? 
1 1 1    7   13    7 o 259.0480 1.979286   193.7189   319.7   671.2103 10.25460          ?        ? 
1 1 1    7   13    8 o 458.9088 3.171637   447.5016   157.4   2107.606 29.10984          ?        ? 
1 1 1    7   13    9 o 101.3612 1.216400   147.1515   335.5   102.7565 2.465916          ?        ? 
1 1 1    7   13   10 o 188.7118 1.649323   217.5888   100.0   356.2647 6.224934          ?        ? 
1 1 1    7   13   11 o 277.9876 2.255512   295.0714   298.5   773.5157 12.54008          ?        ? 
1 1 1    7   13   12 o 189.6137 1.530460   203.3244   187.9   359.7531 5.803924          ?        ? 
1 1 1    7   13   13 o 142.3493 1.235848   146.1274    86.8   202.7464 3.518441          ?        ? 
1 1 1    7   13   14 o 48.78920 1.078646   58.29599   349.0   23.81714 1.052525          ?        ? 
1 1 1    7   13   15 f 83.21079 1.066122   109.7837   150.1   69.28622 1.774257          ?        ? 
1 1 1    7   13   16 o 94.89848 1.077418   75.41804   315.7   90.12622 2.044906          ?        ? 
1 1 1    7   13   17 o 70.04246 1.030420   79.18113   249.8   49.10781 1.443463          ?        ? 
1 1 1    7   13   18 o 42.35249 1.455591   44.40260   320.6   17.98314 1.232958          ?        ? 
1 1 1    7   13   19 o 92.12891 1.028203   79.77496   276.6   85.07410 1.894545          ?        ? 
1 1 1    7   13   20 o 56.20459 1.070096   61.36922   337.2   31.69604 1.202886          ?        ? 
1 1 1    7   13   21 o 37.05268 1.460889   36.75426   222.3   13.86326 1.082597          ?        ? 
1 1 1    7   13   22 o 11.35433 3.698272   14.74394   267.7   1.383319 0.9623086          ?        ? 
1 1 1    7   13   23 o 10.12032 3.854001   8.558943   175.5  0.9623086 1.082597          ?        ? 
1 1 1    7   14    0 f 44.41161 1.050848   138.6842     0.0   19.75740 0.9322364   19.75740 0.9322364 
1 1 1    7   14    1 o 228.9197 1.740593   283.1428   354.5   524.0974 7.969118          ?        ? 
1 1 1    7   14    2 o 233.3755 1.720245   355.1332   293.9   544.6968 8.029263          ?        ? 
1 1 1    7   14    3 o 76.87010 0.8802164   180.5514    69.3   59.09176 1.353247          ?        ? 
1 1 1    7   14    4 o 281.0371 2.129383   271.0017   194.8   789.9651 11.96871          ?        ? 
1 1 1    7   14    5 o 596.4717 4.015691   591.1544    99.9   3560.331 47.90493          ?        ? 
1 1 1    7   14    6 o 252.9446 1.949768   262.1904   175.7   639.9352 9.863664          ?        ? 
1 1 1    7   14    7 o 274.0928 2.068131   372.7346   114.0   751.4728 11.33720          ?        ? 
1 1 1    7   14    8 o 176.8800 1.504628   186.1494   161.9   312.9307 5.322770          ?        ? 
1 1 1    7   14    9 o 89.02772 1.114687   145.9821   191.7   79.27017 1.984761          ?        ? 
1 1 1    7   14   10 o 59.30947 1.166187   65.74782   196.6   35.18441 1.383319          ?        ? 
1 1 1    7   14   11 o 43.72564 1.237943   63.74550   269.5   19.12588 1.082597          ?        ? 
1 1 1    7   14   12 o 101.6739 1.153505   117.9619     7.4   103.4181 2.345627          ?        ? 
1 1 1    7   14   13 o 61.68747 1.048108   50.37529   139.2   38.07133 1.293102          ?        ? 
1 1 1    7   14   14 o 37.50043 1.283064   38.00135   121.0   14.07376 0.9623086          ?        ? 
1 1 1    7   14   15 o 63.10421 1.048404   68.85025   163.3   39.84559 1.323174          ?        ? 
1 1 1    7   14   16 o 49.69521 1.180007   52.17051   193.7   24.71930 1.172814          ?        ? 
1 1 1    7   14   17 o 59.25383 1.141906   67.58771   303.3   35.15434 1.353247          ?        ? 
1 1 1    7   14   18 o 86.10743 1.257263   88.22723   345.1   74.30827 2.165194          ?        ? 
1 1 1    7   14   19 o 74.43916 1.030156   79.34185   312.2   55.54325 1.533679          ?        ? 
1 1 1    7   14   20 o 44.37349 1.253755   46.84033   106.6   19.78747 1.112669          ?        ? 
1 1 1    7   14   21 o 23.12783 2.145426   19.73318   345.0   5.473131 0.9923807          ?        ? 
1 1 1    7   14   22 o 18.06342 2.830175   28.03730   236.6   3.428224 1.022453          ?        ? 
1 1 1    7   14   23 o 12.65082 3.765144   13.82246   279.5   1.864473 1.022453          ?        ? 
1 1 1    7   15    0 o 40.35922 1.157023   247.0528     0.0   16.32917 0.9322364   16.32917 0.9322364 
1 1 1    7   15    1 o 61.57921 0.8546107   82.49909    25.1   37.92097 1.052525          ?        ? 
1 1 1    7   15    2 o 315.0414 2.142956   341.5221    36.3   992.6815 13.50239          ?        ? 
1 1 1    7   15    3 o 593.7376 3.763212   617.3858   302.3   3527.312 44.68721          ?        ? 
1 1 1    7   15    4 o 260.3947 1.853563   287.9189   342.3   678.1570 9.653158          ?        ? 
1 1 1    7   15    5 o 204.5760 1.734569   144.4580   103.7   418.5742 7.097026          ?        ? 
1 1 1    7   15    6 o 409.0876 2.947763   397.9493   346.9   1674.387 24.11786          ?        ? 
1 1 1    7   15    7 o 228.8692 1.839523   186.4678    66.6   523.9470 8.420200          ?        ? 
1 1 1    7   15    8 o 178.6628 1.498029   178.6318    25.4   319.2759 5.352841          ?        ? 
1 1 1    7   15    9 o 133.3432 1.353147   141.3099    72.9   177.8467 3.608657          ?        ? 
1 1 1    7   15   10 o 154.8212 1.505344   194.2151   356.7   239.7953 4.661182          ?        ? 
1 1 1    7   15   11 o 105.2476 1.271488   134.6801   211.5   110.8159 2.676421          ?        ? 
1 1 1    7   15   12 o 20.27787 2.446955   35.49072     7.7   4.119884 0.9923807          ?        ? 
1 1 1    7   15   13 o 90.83566 1.059395   96.93545    93.2   82.54803 1.924617          ?        ? 
1 1 1    7   15   14 o 92.66577 1.038473   96.58277     3.4   85.91612 1.924617          ?        ? 
1 1 1    7   15   15 o 23.42707 2.182204   21.37483   129.7   5.503202 1.022453          ?        ? 
1 1 1    7   15   16 o 23.42039 2.118625   38.41248    48.0   5.503202 0.9923807          ?        ? 
1 1 1    7   15   17 o 54.65839 1.237913   57.26183   240.5   29.92178 1.353247          ?        ? 
1 1 1    7   15   18 o 83.54187 1.079895   90.03041   117.0   69.91774 1.804329          ?        ? 
1 1 1    7   15   19 o 80.93531 1.151829   85.21429   129.3   65.70763 1.864473          ?        ? 
1 1 1    7   15   20 o 21.87787 2.268001   18.71582   112.1   4.871688 0.9923807          ?        ? 
1 1 1    7   15   21 o 9.403144 3.618653   14.95984   189.5  0.6916593 0.9623086          ?        ? 
1 1 1    7   15   22 o 20.74748 2.464041   23.46177   203.1   4.480750 1.022453          ?        ? 
1 1 1    7   15   23 o 20.49520 2.641099   20.28565   328.5   4.510822 1.082597          ?        ? 
1 1 1    7   16    0 o 194.8027 1.991870   222.9027     0.0   379.6308 7.758613   379.6308 7.758613 
1 1 1    7   16    1 o 294.5761 2.113183   285.4148    94.3   867.9122 12.44987          ?        ? 
1 1 1    7   16    2 o 32.90199 1.096790   32.30659    16.8   10.82597 0.7217315          ?        ? 
1 1 1    7   16    3 o 682.8075 4.283076   797.2694   186.5   4666.054 58.49032          ?        ? 
1 1 1    7   16    4 f 346.2349 2.336393   348.0840    60.2   1199.097 16.17881          ?        ? 
1 1 1    7   16    5 o 280.7587 1.986896   231.0265   118.2   788.4315 11.15676          ?        ? 
1 1 1    7   16    6 o 142.6974 1.296055   202.8388   153.7   203.6486 3.698874          ?        ? 
1 1 1    7   16    7 o 39.38915 1.221540   15.87442   356.3   15.51723 0.9623086          ?        ? 
1 1 1    7   16    8 o 182.5472 1.532047   221.2311   179.0   333.3197 5.593419          ?        ? 
1 1 1    7   16    9 o 232.4617 1.882244   251.6217   304.0   540.6971 8.750995          ?        ? 
1 1 1    7   16   10 o 177.2494 1.662668   190.8394   354.5   314.3441 5.894140          ?        ? 
1 1 1    7   16   11 o 237.1581 2.073214   252.1967   132.8   563.0709 9.833591          ?        ? 
1 1 1    7   16   12 o 111.4138 1.255101   139.8675   197.6   124.1980 2.796710          ?        ? 
1 1 1    7   16   13 o 76.94846 1.094265   82.78795    33.4   59.24213 1.684040          ?        ? 
1 1 1    7   16   14 f 133.2188 1.241542   144.5534   257.2   177.6362 3.307936          ?        ? 
1 1 1    7   16   15 o 99.85103 1.099271   113.7083   288.5   99.77937 2.195267          ?        ? 
1 1 1    7   16   16 o 54.80987 1.124759   61.96899   289.3   30.07215 1.232958          ?        ? 
1 1 1    7   16   17 o 54.05067 1.140558   60.48754   115.6   29.26020 1.232958          ?        ? 
1 1 1    7   16   18 o 33.69129 1.606642   35.32405   235.1   11.39734 1.082597          ?        ? 
1 1 1    7   16   19 o 48.31937 1.338078   40.41518   278.8   23.45627 1.293102          ?        ? 
1 1 1    7   16   20 o 36.65543 1.599782   30.28145   196.5   13.56254 1.172814          ?        ? 
1 1 1    7   16   21 o 43.56537 1.311525   37.45186   131.8   19.15596 1.142741          ?        ? 
1 1 1    7   16   22 o 46.54873 1.259770   47.35075   303.2   21.92259 1.172814          ?        ? 
1 1 1    7   16   23 o 14.63724 3.776761   8.994400   200.3   2.586205 1.112669          ?        ? 
1 1 1    7   17    0 o 139.5081 1.638752   152.8743   180.0   194.7171 4.570966   194.7171 4.570966 
1 1 1    7   17    1 o 159.5629 1.243874   154.4240   178.2   254.6208 3.969523          ?        ? 
1 1 1    7   17    2 o 242.7418 1.814920   273.8145   291.3   589.3238 8.811138          ?        ? 
1 1 1    7   17    3 o 179.9232 1.445751   261.8773    41.0   323.7567 5.202481          ?        ? 
1 1 1    7   17    4 o 287.3410 2.030339   379.4742   303.6   825.8412 11.66799          ?        ? 
1 1 1    7   17    5 o 431.1412 2.870217   380.9723    55.2   1859.812 24.74938          ?        ? 
1 1 1    7   17    6 o 67.51685 1.024425   114.0368   123.2   45.58937 1.383319          ?        ? 
1 1 1    7   17    7 o 245.8455 1.932677   220.8132   223.9   604.6306 9.502798          ?        ? 
1 1 1    7   17    8 o 76.17782 1.065859   69.78006   266.0   58.03924 1.623896          ?        ? 
1 1 1    7   17    9 o 234.0418 1.843838   212.6842   241.7   548.0949 8.630706          ?        ? 
1 1 1    7   17   10 o 193.3849 1.718320   226.0297   287.1   374.2478 6.645944          ?        ? 
1 1 1    7   17   11 o 179.9113 1.913865   204.1067    61.3   324.0574 6.886521          ?        ? 
1 1 1    7   17   12 o 57.10401 1.184896   74.99534   220.3   32.62828 1.353247          ?        ? 
1 1 1    7   17   13 o 118.9136 1.302388   143.9491   277.1   141.5195 3.097431          ?        ? 
1 1 1    7   17   14 o 76.27261 1.163102   74.10250    66.2   58.21967 1.774257          ?        ? 
1 1 1    7   17   15 o 38.51792 1.405316   22.80587    41.6   14.85564 1.082597          ?        ? 
1 1 1    7   17   16 o 21.10429 2.564875   27.22873   100.5   4.480750 1.082597          ?        ? 
1 1 1    7   17   17 o 26.85913 1.959343   24.84413   148.7   7.247387 1.052525          ?        ? 
1 1 1    7   17   18 o 95.00188 1.202862   92.01541   231.8   90.51716 2.285483          ?        ? 
1 1 1    7   17   19 o 49.78036 1.298808   55.29336   116.2   24.89974 1.293102          ?        ? 
1 1 1    7   17   20 o 71.31671 1.159594   66.65161    85.8   51.12265 1.653968          ?        ? 
1 1 1    7   17   21 o 16.81013 3.065359   13.44853   131.2   3.067359 0.9923807          ?        ? 
1 1 1    7   17   22 o 11.87526 3.745601   11.32460   235.8   1.593824 0.9923807          ?        ? 
1 1 1    7   17   23 o 21.83387 2.548036   24.28592    15.9   5.142337 1.112669          ?        ? 
1 1 1    7   18    0 o 533.1690 4.679410   643.9424    -0.0   2844.885 49.88969   2844.885 49.88969 
1 1 1    7   18    1 o 155.1480 1.230812   166.2179   147.2   240.7275 3.819162          ?        ? 
1 1 1    7   18    2 o 273.5742 1.978618   224.8584    76.2   748.5859 10.82597          ?        ? 
1 1 1    7   18    3 o 268.4202 1.915779   308.2982    25.8   720.6489 10.28467          ?        ? 
1 1 1    7   18    4 o 335.8749 2.336832   336.5099   248.2   1128.517 15.69766          ?        ? 
1 1 1    7   18    5 o 264.3916 1.905161   259.3743   315.5   699.2375 10.07417          ?        ? 
1 1 1    7   18    6 o 219.3299 1.638455   183.3317   151.2   481.1844 7.187243          ?        ? 
1 1 1    7   18    7 o 28.49090 1.530475   75.59742   229.2   8.119479 0.8720922          ?        ? 
1 1 1    7   18    8 o 128.8125 1.225648   123.9204   112.4   165.9682 3.157575          ?        ? 
1 1 1    7   18    9 o 238.8303 1.907601   278.5301   203.7   570.7994 9.111859          ?        ? 
1 1 1    7   18   10 o 238.8667 2.115038   248.7814   230.2   571.2204 10.10424          ?        ? 
1 1 1    7   18   11 o 80.80144 1.153737   93.89691   327.3   65.31670 1.864473          ?        ? 
1 1 1    7   18   12 o 43.81898 1.406877   57.43764   134.9   19.21610 1.232958          ?        ? 
1 1 1    7   18   13 o 71.99863 1.190378   109.1956   327.0   51.87445 1.714112          ?        ? 
1 1 1    7   18   14 o 160.3315 1.575523   162.2458   126.2   257.4176 5.052120          ?        ? 
1 1 1    7   18   15 o 136.9233 1.416599   141.9802    66.7   187.7404 3.879307          ?        ? 
1 1 1    7   18   16 o 46.78607 1.253379   62.74459   319.6   21.92259 1.172814          ?        ? 
1 1 1    7   18   17 o 62.25148 1.159381   70.12512   105.1   38.82314 1.443463          ?        ? 
1 1 1    7   18   18 o 29.42065 1.839860   39.21449   332.0   8.720922 1.082597          ?        ? 
1 1 1    7   18   19 o 44.24050 1.461446   39.66774    88.0   19.69725 1.293102          ?        ? 
1 1 1    7   18   20 o 37.10185 1.580533   32.33662     6.3   13.92340 1.172814          ?        ? 
1 1 1    7   18   21 o 11.37933 4.017301   9.696092   151.3   1.323174 1.142741          ?        ? 
1 1 1    7   18   22 o 20.40533 2.800105   22.70710   180.5   4.450677 1.142741          ?        ? 
1 1 1    7   18   23 o 7.643595 3.362209   7.055362   329.8       0.03 0.9923807          ?        ? 
1 1 1    7   19    0 o 179.3894 1.928316   117.5386   180.0   321.9524 6.916593   321.9524 6.916593 
1 1 1    7   19    1 o 278.9284 1.886730   295.8303   303.7   778.1769 10.52525          ?        ? 
1 1 1    7   19    2 o 98.09391 1.057649   95.22297   226.3   96.23087 2.074978          ?        ? 
1 1 1    7   19    3 o 226.4192 1.713329   257.5455   145.3   512.7601 7.758613          ?        ? 
1 1 1    7   19    4 o 148.2661 1.257518   174.0210    87.8   219.8574 3.728946          ?        ? 
1 1 1    7   19    5 o 147.5022 1.243643   96.45950   241.3   217.6020 3.668802          ?        ? 
1 1 1    7   19    6 o 46.75479 0.9969423   108.9497   129.2   21.86245 0.9322364          ?        ? 
1 1 1    7   19    7 o 149.2674 1.319596   125.8252    46.9   222.8647 3.939451          ?        ? 
1 1 1    7   19    8 o 54.64034 1.045694   51.24576   238.8   29.86164 1.142741          ?        ? 
1 1 1    7   19    9 o 110.0812 1.188339   127.7953   143.1   121.2208 2.616277          ?        ? 
1 1 1    7   19   10 o 182.8319 1.817501   197.7949   351.5   334.6127 6.645944          ?        ? 
1 1 1    7   19   11 o 152.9262 1.523997   173.2540   335.0   234.0816 4.661182          ?        ? 
1 1 1    7   19   12 o 150.0080 1.523574   159.3574   307.8   225.2704 4.570966          ?        ? 
1 1 1    7   19   13 o 37.64619 1.597620   35.98267   296.2   14.19405 1.202886          ?        ? 
1 1 1    7   19   14 o 75.47315 1.235190   73.18869    93.1   57.01679 1.864473          ?        ? 
1 1 1    7   19   15 o 24.65313 2.378631   42.41166   299.6   6.104645 1.172814          ?        ? 
1 1 1    7   19   16 o 49.70560 1.270511   46.64238    43.7   24.74938 1.263030          ?        ? 
1 1 1    7   19   17 o 14.68909 3.520857   21.25906    53.5   2.285483 1.022453          ?        ? 
1 1 1    7   19   18 o 45.01363 1.436345   44.09075   189.6   20.35884 1.293102          ?        ? 
1 1 1    7   19   19 o 20.80414 2.529605   17.24842   280.6   4.420605 1.052525          ?        ? 
1 1 1    7   19   20 f 35.24781 1.663669   34.43416   145.7   12.60023 1.172814          ?        ? 
1 1 1    7   19   21 o 46.93187 1.505790   44.12678   131.1   22.34361 1.413391          ?        ? 
1 1 1    7   19   22 o 22.50386 2.472174   18.63118    69.8   5.352841 1.112669          ?        ? 
1 1 1    7   20    0 o 312.4820 2.950236   364.0348   180.0   977.0139 18.43423   977.0139 18.43423 
1 1 1    7   20    1 o 256.6698 1.745726   294.7083   156.4   658.9408 8.961499          ?        ? 
1 1 1    7   20    2 o 158.9724 1.295786   200.9782    13.7   252.7564 4.119884          ?        ? 
1 1 1    7   20    3 o 149.0533 1.301315   138.0579     2.2   222.2031 3.879307          ?        ? 
1 1 1    7   20    4 o 198.3897 1.515812   257.2256   140.7   393.6744 6.014429          ?        ? 
1 1 1    7   20    5 o 211.9034 1.624920   165.7224   318.2   449.1575 6.886521          ?        ? 
1 1 1    7   20    6 o 227.5897 1.691304   222.0787    79.7   518.1731 7.698469          ?        ? 
1 1 1    7   20    7 o 141.7231 1.262527   124.8871   289.3   200.9120 3.578585          ?        ? 
1 1 1    7   20    8 o 149.1500 1.290390   136.9535   133.8   222.5339 3.849235          ?        ? 
1 1 1    7   20    9 o 71.02772 0.9526186   101.4351   297.4   50.46106 1.353247          ?        ? 
1 1 1    7   20   10 o 107.9463 1.323275   129.4761   172.9   116.5897 2.856854          ?        ? 
1 1 1    7   20   11 o 60.52696 1.242097   66.77967   354.8   36.65794 1.503607          ?        ? 
1 1 1    7   20   12 o 124.5973 1.375722   129.4809   127.9   155.3828 3.428224          ?        ? 
1 1 1    7   20   13 f 78.80838 1.221074   71.65913    70.0   62.15912 1.924617          ?        ? 
1 1 1    7   20   14 o 17.68076 3.269622   19.83270   206.8   3.247792 1.112669          ?        ? 
1 1 1    7   20   15 o 50.57141 1.427153   55.29160   197.3   25.62147 1.443463          ?        ? 
1 1 1    7   20   16 o 25.05046 2.280879   11.65139   134.7   6.315150 1.142741          ?        ? 
1 1 1    7   20   17 o 20.83393 2.598159   30.57158   265.4   4.390533 1.082597          ?        ? 
1 1 1    7   20   18 o 15.94017 3.316908   20.85054    31.7   2.706493 1.022453          ?        ? 
1 1 1    7   20   19 o 24.30428 2.227174   28.12556    85.2   6.014429 1.082597          ?        ? 
1 1 1    7   20   20 o 18.80384 2.958623   28.93250   260.4   3.698874 1.112669          ?        ? 
1 1 1    7   20   21 o 38.10490 1.736226   42.45774   215.5   14.82557 1.323174          ?        ? 
1 1 1    7   20   22 o 6.154027 2.974259   10.41525   187.0  -1.473535 1.112669          ?        ? 
1 1 1    7   21    0 o 102.4841 1.438453   119.3307   180.0   105.1021 2.947070   105.1021 2.947070 
1 1 1    7   21    1 o 268.1310 1.844945   230.2251   183.2   719.1754 9.893736          ?        ? 
1 1 1    7   21    2 o 164.7653 1.304983   156.3699   249.9   271.5214 4.300317          ?        ? 
1 1 1    7   21    3 o 103.4622 1.075436   91.67205     7.7   107.0568 2.225339          ?        ? 
1 1 1    7   21    4 o 112.4307 1.096638   104.0038   125.5   126.4233 2.465916          ?        ? 
1 1 1    7   21    5 o 333.9056 2.305583   298.4981   217.6   1115.737 15.39694          ?        ? 
1 1 1    7   21    6 o 214.1129 1.643265   235.3024   287.3   458.6603 7.036882          ?        ? 
1 1 1    7   21    7 o 108.1144 1.223865   73.86258   183.9   116.9205 2.646349          ?        ? 
1 1 1    7   21    8 o 63.94336 1.011131   99.83953   266.2   40.89812 1.293102          ?        ? 
1 1 1    7   21    9 o 27.07757 1.554829   38.39610    30.4   7.337603 0.8420200          ?        ? 
1 1 1    7   21   10 o 89.77044 1.055217   101.8281   267.0   80.62342 1.894545          ?        ? 
1 1 1    7   21   11 o 245.2514 2.139678   274.3739   250.0   602.7360 10.49518          ?        ? 
1 1 1    7   21   12 o 37.08261 1.662448   42.29740   326.6   13.77304 1.232958          ?        ? 
1 1 1    7   21   13 o 30.44706 2.024757   38.65480   220.6   9.292293 1.232958          ?        ? 
1 1 1    7   21   14 o 116.7221 1.313958   129.3049    71.3   136.4073 3.067359          ?        ? 
1 1 1    7   21   15 o 91.31673 1.234939   82.71981   304.1   83.51035 2.255411          ?        ? 
1 1 1    7   21   16 o 61.68423 1.291921   54.62846   292.9   38.13148 1.593824          ?        ? 
1 1 1    7   21   17 o 12.26330 3.721484   22.34799   320.3   1.563751 0.9923807          ?        ? 
1 1 1    7   21   18 o 49.13441 1.346484   46.46710    75.8   24.26822 1.323174          ?        ? 
1 1 1    7   21   19 f 45.40553 1.423948   35.10754    94.7   20.77985 1.293102          ?        ? 
1 1 1    7   21   20 o 23.75769 2.151836   28.39160    70.1   5.803924 1.022453          ?        ? 
1 1 1    7   21   21 o 24.14140 2.429051   25.61436    20.0   6.104645 1.172814          ?        ? 
1 1 1    7   21   22 o 13.93283 4.066223   22.92656    71.3   2.405771 1.202886          ?        ? 
1 1 1    7   22    0 o 703.9944 5.942811   776.4965   180.0   4966.264 83.66071   4966.264 83.66071 
1 1 1    7   22    1 o 137.4690 1.148468   95.21397   164.3   189.0034 3.157575          ?        ? 
1 1 1    7   22    2 o 426.6614 2.685382   443.1796   154.8   1821.831 22.91497          ?        ? 
1 1 1    7   22    3 o 208.7779 1.598832   139.0849   340.2   436.0160 6.676016          ?        ? 
1 1 1    7   22    4 o 208.9729 1.590145   196.3474    98.4   436.8580 6.645944          ?        ? 
1 1 1    7   22    5 o 84.98228 1.026205   109.0253   169.5   72.23329 1.744184          ?        ? 
1 1 1    7   22    6 o 100.5392 1.061836   190.5111   254.4   101.1026 2.135122          ?        ? 
1 1 1    7   22    7 f 44.94664 1.137408   27.82296   306.3   20.20848 1.022453          ?        ? 
1 1 1    7   22    8 o 112.8942 1.238642   85.27110   273.7   127.5059 2.796710          ?        ? 
1 1 1    7   22    9 o 67.73063 1.021191   89.88304   235.1   45.89009 1.383319          ?        ? 
1 1 1    7   22   10 f 113.3549 1.127491   92.89816   149.8   128.5584 2.556132          ?        ? 
1 1 1    7   22   11 o 98.98255 1.139297   115.4055   293.3   98.03519 2.255411          ?        ? 
1 1 1    7   22   12 o 119.5659 1.232404   129.9900    59.1   143.0833 2.947070          ?        ? 
1 1 1    7   22   13 o 31.16814 2.122639   19.45585    75.8   9.743376 1.323174          ?        ? 
1 1 1    7   22   14 o 107.1209 1.291362   102.7081    38.0   114.9057 2.766637          ?        ? 
1 1 1    7   22   15 o 119.3582 1.347926   130.0608   192.9   142.7525 3.217719          ?        ? 
1 1 1    7   22   16 o 71.76960 1.257029   81.43035   104.6   51.63387 1.804329          ?        ? 
1 1 1    7   22   17 o 82.61999 1.328532   86.87296    68.7   68.53442 2.195267          ?        ? 
1 1 1    7   22   18 o 16.40782 3.412209   21.52157   138.4   2.886926 1.082597          ?        ? 
1 1 1    7   22   19 o 40.40406 1.525785   37.70654   252.6   16.50961 1.232958          ?        ? 
1 1 1    7   22   20 o 27.06717 2.055386   23.44287   308.5   7.518036 1.112669          ?        ? 
1 1 1    7   22   21 o 7.716192 3.441160   9.522600   353.6 -0.2105050 1.082597          ?        ? 
1 1 1    7   22   22 o 9.626090 3.841664   6.226378   186.0  0.8420200 1.112669          ?        ? 
1 1 1    7   23    0 o 36.01607 1.889668   147.5107   180.0   13.08138 1.353247   13.08138 1.353247 
1 1 1    7   23    1 o 163.3478 1.353127   178.9847    80.3   266.8903 4.420605          ?        ? 
1 1 1    7   23    2 o 145.0006 1.182142   147.8603    68.0   210.2945 3.428224          ?        ? 
1 1 1    7   23    3 f 339.3338 2.375046   443.1604   331.7   1152.545 16.11867          ?        ? 
1 1 1    7   23    4 o 26.69018 1.633733   2.566514    66.9   7.127099 0.8720922          ?        ? 
1 1 1    7   23    5 o 212.8003 1.632203   203.9392   240.0   453.0669 6.946666          ?        ? 
1 1 1    7   23    6 o 62.37241 1.036598   40.89790   247.9   38.91335 1.293102          ?        ? 
1 1 1    7   23    7 o 118.5449 1.255702   168.4223   249.8   140.5873 2.977142          ?        ? 
1 1 1    7   23    8 o 28.69431 1.519626   39.66536   235.7   8.239767 0.8720922          ?        ? 
1 1 1    7   23    9 f 38.05815 1.303769   37.41169   168.3   14.49477 0.9923807          ?        ? 
1 1 1    7   23   10 f 99.41048 1.058767   91.01345    87.9   98.87720 2.105050          ?        ? 
1 1 1    7   23   11 o 135.0667 1.369277   132.9248     8.5   182.6281 3.698874          ?        ? 
1 1 1    7   23   12 o 165.6351 1.579543   189.0869    47.4   274.7391 5.232553          ?        ? 
1 1 1    7   23   13 o 105.9308 1.178122   90.64055   319.7   112.3195 2.495988          ?        ? 
1 1 1    7   23   14 o 98.13715 1.332970   88.75852   300.9   96.47144 2.616277          ?        ? 
1 1 1    7   23   15 o 37.96939 1.663221   29.20816   205.6   14.46470 1.263030          ?        ? 
1 1 1    7   23   16 o 68.01962 1.282119   54.62911   352.5   46.40132 1.744184          ?        ? 
1 1 1    7   23   17 o 47.65185 1.577701   67.84103   231.8   22.85483 1.503607          ?        ? 
1 1 1    7   23   18 o 59.84787 1.356686   58.73970    63.7   36.05650 1.623896          ?        ? 
1 1 1    7   23   19 o 29.57025 2.033946   28.64253   237.7   8.931427 1.202886          ?        ? 
1 1 1    7   23   20 o 35.97346 1.755503   33.83064   161.1   13.20167 1.263030          ?        ? 
1 1 1    7   23   21 o 8.744282 3.748013   5.329841   200.2  0.2405772 1.172814          ?        ? 
1 1 1    7   24    0 o 90.72054 1.326560   93.28241    -0.0   82.36760 2.405771   82.36760 2.405771 
1 1 1    7   24    1 o 109.9666 1.052845   96.41437   124.9   120.9502 2.315555          ?        ? 
1 1 1    7   24    2 o 175.5037 1.362214   168.3378   246.3   308.1192 4.781471          ?        ? 
1 1 1    7   24    3 o 222.3242 1.677256   239.0919   212.6   494.5364 7.457891          ?        ? 
1 1 1    7   24    4 o 166.5777 1.435207   166.6318   204.8   277.5959 4.781471          ?        ? 
1 1 1    7   24    5 o 173.6382 1.420146   159.9310    49.6   301.6537 4.931832          ?        ? 
1 1 1    7   24    6 o 76.56680 1.021168   72.68827     3.0   58.64068 1.563751          ?        ? 
1 1 1    7   24    7 o 50.93401 1.062745   48.19084    57.0   25.95226 1.082597          ?        ? 
1 1 1    7   24    8 o 144.4718 1.384213   137.7324    26.1   208.8811 3.999595          ?        ? 
1 1 1    7   24    9 o 103.1822 1.063782   98.24263    72.9   106.5155 2.195267          ?        ? 
1 1 1    7   24   10 o 158.0998 1.340979   163.0803   257.8   250.1702 4.240172          ?        ? 
1 1 1    7   24   11 o 31.32935 1.823756   57.57506   166.1   9.833591 1.142741          ?        ? 
1 1 1    7   24   12 o 112.4866 1.256497   86.41900   244.4   126.6639 2.826782          ?        ? 
1 1 1    7   24   13 o 41.47258 1.522729   20.52768   125.5   17.23134 1.263030          ?        ? 
1 1 1    7   24   14 o 90.29584 1.165641   89.60610   339.8   81.64587 2.105050          ?        ? 
1 1 1    7   24   15 o 56.20505 1.284104   52.60251    27.1   31.66597 1.443463          ?        ? 
1 1 1    7   24   16 o 49.44294 1.307671   34.97277    12.0   24.53887 1.293102          ?        ? 
1 1 1    7   24   17 o 16.02698 3.646167   16.92131    89.3   2.766637 1.142741          ?        ? 
1 1 1    7   24   18 o 19.24426 3.203443   17.95945     8.4   3.849235 1.232958          ?        ? 
1 1 1    7   24   19 o 31.00530 1.842816   30.93401    88.7   9.803518 1.142741          ?        ? 
1 1 1    7   24   20 o 35.03012 1.802777   23.94878    16.9   12.57016 1.263030          ?        ? 
1 1 1    7   24   21 o 8.667480 3.653128   12.49047   173.2  0.3909379 1.082597          ?        ? 
1 1 1    7   25    0 o 49.80397 1.421511   49.66607   180.0   24.86966 1.413391   24.86966 1.413391 
1 1 1    7   25    1 o 142.8858 1.199638   123.5436   329.9   204.2199 3.428224          ?        ? 
1 1 1    7   25    2 o 160.0856 1.314953   184.0085   230.1   256.3650 4.210100          ?        ? 
1 1 1    7   25    3 o 160.1690 1.436307   136.4826   117.6   256.6657 4.601038          ?        ? 
1 1 1    7   25    4 o 133.9164 1.279987   141.0142     3.2   179.4104 3.428224          ?        ? 
1 1 1    7   25    5 o 120.5475 1.147530   138.1719    51.2   145.3687 2.766637          ?        ? 
1 1 1    7   25    6 o 229.0427 1.785611   222.9615   176.2   525.1499 8.179624          ?        ? 
1 1 1    7   25    7 o 94.04054 1.039280   134.9414    76.9   88.47225 1.954689          ?        ? 
1 1 1    7   25    8 o 15.39522 3.136469   21.58758    57.7   2.465916 0.9322364          ?        ? 
1 1 1    7   25    9 o 67.54682 1.046230   69.76078   143.2   45.64952 1.413391          ?        ? 
1 1 1    7   25   10 o 114.7511 1.113772   103.4119   182.8   131.7761 2.556132          ?        ? 
1 1 1    7   25   11 o 51.03379 1.355297   54.22093   170.9   26.07255 1.383319          ?        ? 
1 1 1    7   25   12 o 99.39980 1.240403   88.99689   222.7   98.90728 2.465916          ?        ? 
1 1 1    7   25   13 o 111.4986 1.240661   98.83495   187.8   124.4987 2.766637          ?        ? 
1 1 1    7   25   14 o 45.42147 1.522758   64.65099   182.3   20.68964 1.383319          ?        ? 
1 1 1    7   25   15 o 56.06359 1.314164   58.70933   228.0   31.51561 1.473535          ?        ? 
1 1 1    7   25   16 o 56.44791 1.331854   47.98232   210.4   31.99676 1.503607          ?        ? 
1 1 1    7   25   17 o 6.985481 3.257140   7.494929    95.3 -0.9623086 1.112669          ?        ? 
1 1 1    7   25   18 o 32.04217 1.830110   31.12216   164.8   10.43503 1.172814          ?        ? 
1 1 1    7   25   19 o 21.70065 2.355811   13.87427   175.3   4.871688 1.022453          ?        ? 
1 1 1    7   25   20 o 14.91765 3.963425   5.959464   313.5   2.616277 1.202886          ?        ? 
1 1 1    7   25   21 o 34.48463 1.962101   27.90343   142.3   12.44987 1.353247          ?        ? 
1 1 1    7   26    0 o 211.5754 2.239179   191.9462     0.0   448.0750 9.472726   448.0750 9.472726 
1 1 1    7   26    1 o 45.31421 1.028636   37.96566    25.1   20.53928 0.9322364          ?        ? 
1 1 1    7   26    2 o 99.22731 1.015262   113.2244   353.5   98.48627 2.014834          ?        ? 
1 1 1    7   26    3 f 127.2680 1.169635   197.1503     8.3   162.0287 2.977142          ?        ? 
1 1 1    7   26    4 o 79.09499 1.026548   71.40282    66.1   62.58014 1.623896          ?        ? 
1 1 1    7   26    5 o 16.43276 2.653517   15.92021   168.9   2.706493 0.8720922          ?        ? 
1 1 1    7   26    6 o 18.32814 2.625222   47.31264   253.1   3.368080 0.9623086          ?        ? 
1 1 1    7   26    7 o 22.85329 2.171199   17.01431   124.1   5.232553 0.9923807          ?        ? 
1 1 1    7   26    8 o 77.66699 1.064782   69.27855   267.0   60.35479 1.653968          ?        ? 
1 1 1    7   26    9 o 43.29836 1.284886   61.63315   307.1   18.76502 1.112669          ?        ? 
1 1 1    7   26   10 o 61.33927 1.103083   67.69147   170.5   37.65033 1.353247          ?        ? 
1 1 1    7   26   11 o 81.24609 1.165930   69.38580   287.3   66.06850 1.894545          ?        ? 
1 1 1    7   26   12 o 91.00232 1.189637   89.27045   357.9   82.90891 2.165194          ?        ? 
1 1 1    7   26   13 o 43.67556 1.618057   40.09789   353.1   19.12588 1.413391          ?        ? 
1 1 1    7   26   14 o 13.79351 4.011703   14.49062    47.1   1.984761 1.172814          ?        ? 
1 1 1    7   26   15 o 32.69785 1.793411   33.86959    25.6   10.76583 1.172814          ?        ? 
1 1 1    7   26   16 o 49.64984 1.362790   57.00549   193.5   24.77945 1.353247          ?        ? 
1 1 1    7   26   17 o 28.34742 1.962559   29.17733   141.4   8.149551 1.112669          ?        ? 
1 1 1    7   26   18 o 7.554608 3.437536   1.822667   220.2 -0.5713707 1.142741          ?        ? 
1 1 1    7   26   19 f 30.65654 1.912828   29.24627    27.5   9.623086 1.172814          ?        ? 
1 1 1    7   26   20 o 8.951269 3.637768   7.868894   252.2  0.5412986 1.022453          ?        ? 
1 1 1    7   27    0 o 77.13000 1.463259   131.8920     0.0   59.57292 2.255411   59.57292 2.255411 
1 1 1    7   27    1 o 108.3457 1.124108   107.2398   244.2   117.4317 2.435844          ?        ? 
1 1 1    7   27    2 o 209.9643 1.625604   210.0686   247.1   441.2185 6.826377          ?        ? 
1 1 1    7   27    3 o 41.68235 1.154336   79.73862   359.6   17.38170 0.9623086          ?        ? 
1 1 1    7   27    4 o 53.74705 1.119025   79.95641    11.4   28.89933 1.202886          ?        ? 
1 1 1    7   27    5 o 106.4628 1.115741   95.99126   129.6   113.4021 2.375700          ?        ? 
1 1 1    7   27    6 o 69.58909 1.015526   91.31282    57.1   48.44623 1.413391          ?        ? 
1 1 1    7   27    7 o 187.9764 1.503796   193.6310   323.9   353.7386 5.653563          ?        ? 
1 1 1    7   27    8 o 42.73955 1.336866   64.03016   355.3   18.28386 1.142741          ?        ? 
1 1 1    7   27    9 o 109.5395 1.153036   112.0935   355.2   120.0781 2.526060          ?        ? 
1 1 1    7   27   10 o 55.89656 1.237392   56.43664   246.6   31.27503 1.383319          ?        ? 
1 1 1    7   27   11 o 54.85572 1.370511   57.41155   220.7   30.13229 1.503607          ?        ? 
1 1 1    7   27   12 o 34.48323 2.049389   38.18518   197.2   11.93864 1.413391          ?        ? 
1 1 1    7   27   13 o 31.75789 1.988529   22.46515   150.5   10.13431 1.263030          ?        ? 
1 1 1    7   27   14 o 67.55636 1.201882   73.29242   252.2   45.73973 1.623896          ?        ? 
1 1 1    7   27   15 o 42.74271 1.583014   42.75938    67.4   18.37408 1.353247          ?        ? 
1 1 1    7   27   16 o 46.93532 1.409572   44.04629    96.3   22.16317 1.323174          ?        ? 
1 1 1    7   27   17 o 17.90322 3.398403   20.14419    75.5   3.458297 1.172814          ?        ? 
1 1 1    7   27   18 o 40.09769 1.687437   39.88299   248.0   16.35925 1.353247          ?        ? 
1 1 1    7   27   19 o 7.610616 3.456208   7.039322    61.5 -0.4510822 1.142741          ?        ? 
1 1 1    7   27   20 o 10.77957 3.640031   13.12636   144.9   1.323174 0.9322364          ?        ? 
1 1 1    7   28    0 o 144.8525 1.775624   200.5665   180.0   210.0239 5.142337   210.0239 5.142337 
1 1 1    7   28    1 o 59.66038 1.008111   33.92414   157.2   35.60542 1.202886          ?        ? 
1 1 1    7   28    2 o 51.37430 1.053637   40.21933   266.9   26.40334 1.082597          ?        ? 
1 1 1    7   28    3 o 173.2506 1.388608   180.2729   307.1   300.3907 4.811543          ?        ? 
1 1 1    7   28    4 o 77.37960 1.049305   87.59892    73.4   59.90371 1.623896          ?        ? 
1 1 1    7   28    5 o 109.5820 1.070261   118.7231     5.3   120.1382 2.345627          ?        ? 
1 1 1    7   28    6 o 118.5313 1.154364   141.1411    41.0   140.5873 2.736565          ?        ? 
1 1 1    7   28    7 o 36.84861 1.428175   43.09438   228.7   13.59261 1.052525          ?        ? 
1 1 1    7   28    8 o 66.01036 1.116139   83.55376    75.2   43.60461 1.473535          ?        ? 
1 1 1    7   28    9 o 41.73309 1.549253   42.40720    80.0   17.44184 1.293102          ?        ? 
1 1 1    7   28   10 o 155.6039 1.323837   173.4732    47.9   242.4115 4.119884          ?        ? 
1 1 1    7   28   11 o 57.00711 1.186910   49.53301    40.7   32.53806 1.353247          ?        ? 
1 1 1    7   28   12 o 127.3161 1.299104   120.8272   295.7   162.3896 3.307936          ?        ? 
1 1 1    7   28   13 o 73.12733 1.213128   72.95927   296.3   53.58856 1.774257          ?        ? 
1 1 1    7   28   14 o 43.84550 1.646079   40.74768   293.1   19.33639 1.443463          ?        ? 
1 1 1    7   28   15 o 44.11598 1.465571   62.43683    27.4   19.57697 1.293102          ?        ? 
1 1 1    7   28   16 o 32.32344 1.907219   24.44286     9.2   10.58539 1.232958          ?        ? 
1 1 1    7   28   17 o 36.06468 1.834446   31.97920   333.0   13.23174 1.323174          ?        ? 
1 1 1    7   28   18 o 35.18906 1.794634   27.06525    77.4   12.63030 1.263030          ?        ? 
1 1 1    7   28   19 o 11.26974 4.153219   2.502944    78.0   1.323174 1.232958          ?        ? 
1 1 1    7   28   20 o 43.26623 1.598612   41.14009   116.4   19.30632 1.383319          ?        ? 
1 1 1    7   29    0 o 98.61009 1.433992   117.4177   180.0   97.34354 2.826782   97.34354 2.826782 
1 1 1    7   29    1 o 66.61002 0.9706514   93.71709   299.2   44.38649 1.293102          ?        ? 
1 1 1    7   29    2 o 14.41702 3.017614   21.29964    26.5   2.165194 0.8420200          ?        ? 
1 1 1    7   29    3 o 200.7206 1.468245   200.2596   204.3   403.2374 5.894140          ?        ? 
1 1 1    7   29    4 o 193.0990 1.541770   201.6082   244.4   373.2856 5.954284          ?        ? 
1 1 1    7   29    5 o 86.12759 1.047474   95.15833   269.0   74.21806 1.804329          ?        ? 
1 1 1    7   29    6 o 64.72488 1.091845   57.11031   191.0   41.92057 1.413391          ?        ? 
1 1 1    7   29    7 o 55.60514 1.189795   57.10060    81.6   30.94424 1.323174          ?        ? 
1 1 1    7   29    8 o 87.03867 1.105610   107.1455    25.9   75.81188 1.924617          ?        ? 
1 1 1    7   29    9 o 114.5894 1.115344   115.5259   266.7   131.4153 2.556132          ?        ? 
1 1 1    7   29   10 o 20.81866 2.744513   27.31657   340.7   4.360461 1.142741          ?        ? 
1 1 1    7   29   11 o 78.00621 1.137253   72.50119   151.9   60.92617 1.774257          ?        ? 
1 1 1    7   29   12 o 63.69179 1.369238   50.37107   339.0   40.65754 1.744184          ?        ? 
1 1 1    7   29   13 o 40.23655 1.756352   46.15054   263.7   16.26903 1.413391          ?        ? 
1 1 1    7   29   14 o 73.41223 1.290347   69.37785   328.7   54.09978 1.894545          ?        ? 
1 1 1    7   29   15 o 41.56862 1.591554   45.36110   164.4   17.41177 1.323174          ?        ? 
1 1 1    7   29   16 o 11.25531 4.012870   14.98102   303.7   1.202886 1.142741          ?        ? 
1 1 1    7   29   17 o 13.44090 4.100886   13.83244   359.0   2.014834 1.202886          ?        ? 
1 1 1    7   29   18 o 44.51357 1.621374   33.15586   331.2   20.17841 1.443463          ?        ? 
1 1 1    7   29   19 o 16.60942 3.544457   11.79431   298.4   3.187647 1.142741          ?        ? 
1 1 1    7   30    0 o 22.40059 2.825010   48.68324     0.0   5.262625 1.232958   5.262625 1.232958 
1 1 1    7   30    1 o 80.68848 0.9876403   104.3204   293.4   65.13627 1.593824          ?        ? 
1 1 1    7   30    2 o 32.28699 1.443672   42.39929   124.0   10.43503 0.9322364          ?        ? 
1 1 1    7   30    3 o 206.1288 1.495373   191.1413   300.7   425.3404 6.164790          ?        ? 
1 1 1    7   30    4 o 92.29076 1.075276   86.26400   358.9   85.22446 1.984761          ?        ? 
1 1 1    7   30    5 o 52.54758 1.201797   51.88802    19.3   27.63630 1.263030          ?        ? 
1 1 1    7   30    6 o 144.2414 1.292606   122.0039   221.1   208.2496 3.728946          ?        ? 
1 1 1    7   30    7 o 89.32130 1.111024   93.47678   267.0   79.84155 1.984761          ?        ? 
1 1 1    7   30    8 o 16.35582 3.420331   10.59331    27.6   2.796710 1.082597          ?        ? 
1 1 1    7   30    9 f 69.19835 1.173363   104.5011    94.2   47.93500 1.623896          ?        ? 
1 1 1    7   30   10 o 144.2999 1.333762   161.5064    48.0   208.5804 3.849235          ?        ? 
1 1 1    7   30   11 o 74.20605 1.134706   62.80172   306.6   55.15231 1.684040          ?        ? 
1 1 1    7   30   12 o 69.39888 1.343302   62.63606   200.8   48.29587 1.864473          ?        ? 
1 1 1    7   30   13 o 13.31239 4.434069   9.989222    43.8   1.774257 1.383319          ?        ? 
1 1 1    7   30   14 o 35.44380 1.909003   34.09166   181.9   12.69044 1.353247          ?        ? 
1 1 1    7   30   15 o 46.62875 1.515579   41.76767   248.1   21.92259 1.413391          ?        ? 
1 1 1    7   30   16 o 17.48689 3.645109   23.52640   248.1   3.368080 1.232958          ?        ? 
1 1 1    7   30   17 o 26.96421 2.342049   25.67713   188.8   7.518036 1.263030          ?        ? 
1 1 1    7   30   18 o 55.35145 1.412566   47.74984   172.1   31.15474 1.563751          ?        ? 
1 1 1    7   30   19 o 24.15430 2.552254   23.53515   303.5   6.285078 1.232958          ?        ? 
1 1 1    7   31    0 o 153.0956 1.847019   124.8657     0.0   234.6830 5.653563   234.6830 5.653563 
1 1 1    7   31    1 o 101.6803 1.064707   79.73981   112.9   103.4482 2.165194          ?        ? 
1 1 1    7   31    2 o 37.13328 1.376734   42.79952   167.3   13.80311 1.022453          ?        ? 
1 1 1    7   31    3 o 55.60711 1.108633   67.28638   235.2   30.94424 1.232958          ?        ? 
1 1 1    7   31    4 o 42.77281 1.335827   59.32564    25.5   18.31394 1.142741          ?        ? 
1 1 1    7   31    5 o 75.82231 1.090687   71.65456   134.9   57.52802 1.653968          ?        ? 
1 1 1    7   31    6 o 96.31284 1.108431   42.79322   200.3   92.83272 2.135122          ?        ? 
1 1 1    7   31    7 o 39.05322 1.578561   35.19205   107.5   15.27665 1.232958          ?        ? 
1 1 1    7   31    8 o 80.46322 1.121213   82.13842   225.7   64.80547 1.804329          ?        ? 
1 1 1    7   31    9 o 28.65112 1.994236   44.20508   355.4   8.239767 1.142741          ?        ? 
1 1 1    7   31   10 o 99.66142 1.161711   85.68793   232.2   99.47865 2.315555          ?        ? 
1 1 1    7   31   11 o 58.56870 1.206609   51.38798   198.1   34.37246 1.413391          ?        ? 
1 1 1    7   31   12 o 29.81945 2.016948   30.78432   231.0   8.961499 1.202886          ?        ? 
1 1 1    7   31   13 o 52.69237 1.455314   67.77320   306.6   27.90695 1.533679          ?        ? 
1 1 1    7   31   14 o 41.60013 1.590349   46.47903   225.6   17.44184 1.323174          ?        ? 
1 1 1    7   31   15 f 39.56580 1.748124   31.25235   175.8   15.84802 1.383319          ?        ? 
1 1 1    7   31   16 o 37.64101 1.837515   35.51366    26.6   14.43463 1.383319          ?        ? 
1 1 1    7   31   17 o 22.94290 2.752552   34.15010    14.1   5.533275 1.263030          ?        ? 
1 1 1    7   31   18 o 15.08183 4.015223   21.21511   332.6   2.706493 1.232958          ?        ? 
1 1 1    7   31   19 o 19.19334 3.133603   22.49219   271.8   4.149956 1.202886          ?        ? 
1 1 1    7   32    0 o 56.35512 1.496468   49.00595   180.0   31.84640 1.684040   31.84640 1.684040 
1 1 1    7   32    1 o 94.30325 1.020441   112.1874    73.2   88.98347 1.924617          ?        ? 
1 1 1    7   32    2 f 103.0974 1.122994   79.39335    48.5   106.3652 2.315555          ?        ? 
1 1 1    7   32    3 o 60.97220 1.060403   57.94286   155.7   37.19924 1.293102          ?        ? 
1 1 1    7   32    4 o 15.82435 3.334999   41.43435   311.4   2.616277 1.022453          ?        ? 
1 1 1    7   32    5 o 113.1555 1.222494   95.93139   118.5   128.1675 2.766637          ?        ? 
1 1 1    7   32    6 o 108.8265 1.188224   93.87722    74.3   118.5444 2.586205          ?        ? 
1 1 1    7   32    7 o 73.82108 1.140623   71.17932    95.2   54.55087 1.684040          ?        ? 
1 1 1    7   32    8 o 73.50371 1.186460   84.29604   187.9   54.09978 1.744184          ?        ? 
1 1 1    7   32    9 o 98.66830 1.142926   92.00111   216.2   97.49390 2.255411          ?        ? 
1 1 1    7   32   10 o 34.53016 1.741790   43.56900   186.9   11.96871 1.202886          ?        ? 
1 1 1    7   32   11 o 24.35568 2.345945   8.731233   136.4   5.984357 1.142741          ?        ? 
1 1 1    7   32   12 o 28.89140 2.341954   27.68619   215.5   8.450273 1.353247          ?        ? 
1 1 1    7   32   13 o 37.14466 1.781110   43.63280   242.5   13.92340 1.323174          ?        ? 
1 1 1    7   32   14 o 45.01742 1.569826   43.68453    30.4   20.44906 1.413391          ?        ? 
1 1 1    7   32   15 o 88.01928 1.281203   79.17046   279.7   78.12743 2.255411          ?        ? 
1 1 1    7   32   16 o 34.44580 1.964313   35.19260   306.0   12.14915 1.353247          ?        ? 
1 1 1    7   32   17 o 14.73595 4.316823   15.51645   239.0   2.586205 1.353247          ?        ? 
1 1 1    7   32   18 o 15.38875 4.048857   9.228030   100.3   2.916998 1.263030          ?        ? 
1 1 1    7   33    0 o 95.76196 1.539638   54.63051     0.0   91.84032 2.947070   91.84032 2.947070 
1 1 1    7   33    1 o 107.7025 1.061017   102.0423   333.7   116.0785 2.285483          ?        ? 
1 1 1    7   33    2 o 84.12663 1.018769   125.5427   207.6   70.81990 1.714112          ?        ? 
1 1 1    7   33    3 f 76.55087 1.021381   37.17023   222.4   58.64068 1.563751          ?        ? 
1 1 1    7   33    4 o 29.28995 1.950740   11.92256   116.4   8.600634 1.142741          ?        ? 
1 1 1    7   33    5 o 62.22867 1.183968   70.25022   158.6   38.76299 1.473535          ?        ? 
1 1 1    7   33    6 o 140.6342 1.368527   107.0275    62.4   198.0852 3.849235          ?        ? 
1 1 1    7   33    7 f 96.87812 1.164046   81.45351    82.8   93.97545 2.255411          ?        ? 
1 1 1    7   33    8 o 41.52753 1.556922   26.18809    80.1   17.29148 1.293102          ?        ? 
1 1 1    7   33    9 o 25.28542 2.319150   19.57579    23.9   6.435439 1.172814          ?        ? 
1 1 1    7   33   10 o 24.71727 2.433290   37.37313   310.0   6.164790 1.202886          ?        ? 
1 1 1    7   33   11 o 42.51455 1.485409   50.12396    76.3   18.16358 1.263030          ?        ? 
1 1 1    7   33   12 o 23.90384 2.767703   28.38512     2.1   5.833996 1.323174          ?        ? 
1 1 1    7   33   13 o 31.75749 2.225287   30.89978   338.2   10.25460 1.413391          ?        ? 
1 1 1    7   33   14 o 33.24535 2.125697   39.08572   130.9   11.27705 1.413391          ?        ? 
1 1 1    7   33   15 o 12.61120 4.379451   12.05271   116.3   1.684040 1.353247          ?        ? 
1 1 1    7   33   16 o 30.36529 2.228278   29.89382     3.5   9.532870 1.353247          ?        ? 
1 1 1    7   33   17 o 27.69357 2.443250   22.02261    58.1   8.089407 1.353247          ?        ? 
1 1 1    7   33   18 o 7.803844 3.620633   16.35102   254.7 -0.6315150 1.353247          ?        ? 
1 1 1    7   34    0 o 88.05491 1.401008   70.77306   180.0   77.64628 2.465916   77.64628 2.465916 
1 1 1    7   34    1 o 90.57513 1.029241   88.68645   129.0   82.09695 1.864473          ?        ? 
1 1 1    7   34    2 o 52.46056 1.146467   45.94044    77.4   27.54608 1.202886          ?        ? 
1 1 1    7   34    3 o 55.41287 1.112519   31.46155   304.3   30.73373 1.232958          ?        ? 
1 1 1    7   34    4 o 31.26655 1.875508   20.59892   217.4   9.803518 1.172814          ?        ? 
1 1 1    7   34    5 o 45.67718 1.382561   54.44501   294.3   20.90014 1.263030          ?        ? 
1 1 1    7   34    6 o 53.26527 1.298519   49.13522   330.7   28.41818 1.383319          ?        ? 
1 1 1    7   34    7 o 48.81429 1.324512   49.88260   183.4   23.87728 1.293102          ?        ? 
1 1 1    7   34    8 o 60.40891 1.294305   57.55172    43.8   36.56773 1.563751          ?        ? 
1 1 1    7   34    9 o 8.700327 3.763680   12.97851   165.8 -0.1202886 1.202886          ?        ? 
1 1 1    7   34   10 o 62.20411 1.232780   67.46740   135.4   38.82314 1.533679          ?        ? 
1 1 1    7   34   11 o 30.86443 1.997377   26.91593   210.9   9.623086 1.232958          ?        ? 
1 1 1    7   34   12 o 39.14795 1.843600   33.51636   120.2   15.48715 1.443463          ?        ? 
1 1 1    7   34   13 o 41.55541 1.628243   28.98659   316.4   17.44184 1.353247          ?        ? 
1 1 1    7   34   14 o 25.86358 2.557988   18.35637    42.7   6.916593 1.323174          ?        ? 
1 1 1    7   34   15 o 40.23563 1.868502   30.92810   324.8   16.53968 1.503607          ?        ? 
1 1 1    7   34   16 o 44.84492 1.642923   35.10493   302.7   20.56935 1.473535          ?        ? 
1 1 1    7   34   17 o 11.38372 4.384546   5.677090    85.4   1.413391 1.413391          ?        ? 
1 1 1    7   35    0 o 74.78882 1.509223   53.20499   360.0   56.05448 2.255411   56.05448 2.255411 
1 1 1    7   35    1 o 30.93298 1.749908   38.31769    70.0   9.593014 1.082597          ?        ? 
1 1 1    7   35    2 o 70.34167 1.068789   47.96703   149.7   49.52882 1.503607          ?        ? 
1 1 1    7   35    3 o 68.23737 1.057678   69.97154   188.5   46.61182 1.443463          ?        ? 
1 1 1    7   35    4 o 85.26199 1.058108   57.62263    87.4   72.77459 1.804329          ?        ? 
1 1 1    7   35    5 o 28.84883 2.084809   20.60983   298.0   8.360056 1.202886          ?        ? 
1 1 1    7   35    6 o 79.87499 1.148295   74.73589    71.1   63.90331 1.834401          ?        ? 
1 1 1    7   35    7 o 52.16523 1.325901   54.27590   215.1   27.27543 1.383319          ?        ? 
1 1 1    7   35    8 o 75.67637 1.112659   55.60950   344.1   57.37765 1.684040          ?        ? 
1 1 1    7   35    9 o 56.80542 1.297002   75.28391   113.6   32.38770 1.473535          ?        ? 
1 1 1    7   35   10 o 23.41651 2.440034   28.51164   108.2   5.563347 1.142741          ?        ? 
1 1 1    7   35   11 o 34.20523 1.846253   26.21631    69.6   11.81835 1.263030          ?        ? 
1 1 1    7   35   12 o 55.77124 1.509775   53.30747   239.6   31.36525 1.684040          ?        ? 
1 1 1    7   35   13 f 30.11655 2.196757   21.45177   124.1   9.292293 1.323174          ?        ? 
1 1 1    7   35   14 f 16.81656 3.989186   15.09512   237.9   3.217719 1.323174          ?        ? 
1 1 1    7   35   15 o 14.36660 4.342962   9.985531   275.6   2.405771 1.353247          ?        ? 
1 1 1    7   35   16 o 10.38821 4.199479   12.30509   137.2  0.8720922 1.353247          ?        ? 
1 1 1    7   35   17 o 11.04887 4.245254   4.735170    50.8   1.353247 1.323174          ?        ? 
1 1 1    7   36    0 o 55.70303 1.676932   58.82245     0.0   31.15474 1.864473   31.15474 1.864473 
1 1 1    7   36    1 o 36.99017 1.504007   29.66137    68.0   13.71290 1.112669          ?        ? 
1 1 1    7   36    2 o 55.20996 1.171077   47.02231    20.3   30.52323 1.293102          ?        ? 
1 1 1    7   36    3 o 94.13162 1.038275   100.4079   322.8   88.71283 1.954689          ?        ? 
1 1 1    7   36    4 o 66.07648 1.092267   51.69250   274.6   43.72490 1.443463          ?        ? 
1 1 1    7   36    5 o 33.11338 1.770906   10.96946   237.6   11.00640 1.172814          ?        ? 
1 1 1    7   36    6 o 93.88803 1.137058   77.38138   171.9   88.32189 2.135122          ?        ? 
1 1 1    7   36    7 o 60.79302 1.236661   52.70685   192.1   37.04888 1.503607          ?        ? 
1 1 1    7   36    8 o 38.72888 1.708253   33.74966   199.5   15.09622 1.323174          ?        ? 
1 1 1    7   36    9 o 23.72681 2.471494   23.13609   132.5   5.713707 1.172814          ?        ? 
1 1 1    7   36   10 o 78.65530 1.204334   84.72152   285.9   62.12905 1.894545          ?        ? 
1 1 1    7   36   11 o 32.78418 1.880416   27.48236   251.9   10.88612 1.232958          ?        ? 
1 1 1    7   36   12 o 32.47847 2.222184   42.35573   224.5   10.79590 1.443463          ?        ? 
1 1 1    7   36   13 o 10.28512 4.126834   6.774324   326.2  0.7217315 1.293102          ?        ? 
1 1 1    7   36   14 o 12.16374 4.275537   8.221283   106.4   1.563751 1.293102          ?        ? 
1 1 1    7   36   15 o 23.66377 3.113484   22.72170    79.7   6.074574 1.473535          ?        ? 
1 1 1    7   36   16 o 11.41972 4.387636   13.75286   108.5   1.443463 1.413391          ?        ? 
1 1 1    7   37    0 o 23.03590 3.498818   30.76181   180.0   5.593419 1.533679   5.593419 1.533679 
1 1 1    7   37    1 o 57.51666 1.202537   53.69683   218.8   33.13950 1.383319          ?        ? 
1 1 1    7   37    2 o 68.20120 1.102332   74.42793   178.9   46.58175 1.503607          ?        ? 
1 1 1    7   37    3 f 37.38229 1.488231   3.428926   122.8   14.01362 1.112669          ?        ? 
1 1 1    7   37    4 o 16.28037 3.432115   29.59506   117.9   2.796710 1.082597          ?        ? 
1 1 1    7   37    5 o 97.96223 1.181861   93.22723    16.2   96.17072 2.315555          ?        ? 
1 1 1    7   37    6 o 84.93478 1.239216   71.03001   280.5   72.35358 2.105050          ?        ? 
1 1 1    7   37    7 o 18.87666 3.388887   9.991360   356.6   3.759018 1.232958          ?        ? 
1 1 1    7   37    8 o 63.25787 1.259783   53.03530    66.6   40.17639 1.593824          ?        ? 
1 1 1    7   37    9 o 56.88483 1.374489   50.54607   334.9   32.53806 1.563751          ?        ? 
1 1 1    7   37   10 o 8.852140 3.743166   14.73665   251.7  0.1503607 1.142741          ?        ? 
1 1 1    7   37   11 o 18.02501 3.460152   10.85378   210.0   3.518441 1.202886          ?        ? 
1 1 1    7   37   12 o 47.33910 1.651649   45.80317   110.2   22.73454 1.563751          ?        ? 
1 1 1    7   37   13 o 24.29793 3.094105   18.69070   237.9   6.255006 1.503607          ?        ? 
1 1 1    7   37   14 o 19.70871 3.721569   18.52353     4.5   4.420605 1.413391          ?        ? 
1 1 1    7   37   15 o 31.54062 2.288260   25.56840   284.4   10.49518 1.443463          ?        ? 
1 1 1    7   37   16 o 20.06548 3.657451   24.13459    15.9   4.811543 1.413391          ?        ? 
1 1 1    7   38    0 o 22.04455 3.681694   16.06824   180.0   5.232553 1.503607   5.232553 1.503607 
1 1 1    7   38    1 f 97.10624 1.145827   68.91569    57.1   94.48668 2.225339          ?        ? 
1 1 1    7   38    2 o 68.61018 1.051931   53.04419   114.3   47.15312 1.443463          ?        ? 
1 1 1    7   38    3 o 70.47869 1.109379   62.99713    73.6   49.76940 1.563751          ?        ? 
1 1 1    7   38    4 o 29.63358 1.877380   18.41645   226.5   8.841210 1.112669          ?        ? 
1 1 1    7   38    5 o 57.98328 1.270655   60.58194   199.0   33.74094 1.473535          ?        ? 
1 1 1    7   38    6 o 94.96684 1.203306   76.82082    98.5   90.48708 2.285483          ?        ? 
1 1 1    7   38    7 o 48.20382 1.434864   30.64919    77.9   23.36606 1.383319          ?        ? 
1 1 1    7   38    8 o 34.77856 1.772583   27.15298   130.1   12.20929 1.232958          ?        ? 
1 1 1    7   38    9 o 18.04759 3.374347   27.41835   119.6   3.488369 1.172814          ?        ? 
1 1 1    7   38   10 o 76.08293 1.205527   68.86308    95.8   58.24974 1.834401          ?        ? 
1 1 1    7   38   11 o 10.17095 4.014663   12.59463   210.2  0.7518036 1.202886          ?        ? 
1 1 1    7   38   12 o 27.04570 2.668563   26.79879   305.3   7.638325 1.443463          ?        ? 
1 1 1    7   38   13 o 21.14413 3.342277   21.91900   198.8   4.841615 1.413391          ?        ? 
1 1 1    7   38   14 o 21.44253 3.155519   16.12744   241.4   5.022048 1.353247          ?        ? 
1 1 1    7   38   15 o 15.88196 4.517829   14.98237   286.0   3.277864 1.503607          ?        ? 
1 1 1    7   39    0 o 42.73666 2.015018   37.57592   360.0   18.46430 1.714112   18.46430 1.714112 
1 1 1    7   39    1 o 53.05393 1.218668   38.66067   127.2   28.23775 1.293102          ?        ? 
1 1 1    7   39    2 o 34.10217 1.631376   35.52238   302.0   11.69806 1.112669          ?        ? 
1 1 1    7   39    3 o 36.48184 1.566179   28.05336   240.8   13.38210 1.142741          ?        ? 
1 1 1    7   39    4 o 67.41943 1.137416   63.53343    52.0   45.58937 1.533679          ?        ? 
1 1 1    7   39    5 o 23.24868 2.651673   25.63875   306.3   5.503202 1.232958          ?        ? 
1 1 1    7   39    6 o 24.61917 2.442986   17.28466   116.3   6.164790 1.202886          ?        ? 
1 1 1    7   39    7 f 21.63142 2.988945   36.86648   255.1   4.811543 1.293102          ?        ? 
1 1 1    7   39    8 o 59.16296 1.372392   54.39361   242.0   35.24455 1.623896          ?        ? 
1 1 1    7   39    9 o 41.66295 1.624041   41.23143   271.0   17.56213 1.353247          ?        ? 
1 1 1    7   39   10 o 30.78252 2.051538   27.95107   124.7   9.683230 1.263030          ?        ? 
1 1 1    7   39   11 o 39.65393 1.668403   40.84828   230.7   15.99838 1.323174          ?        ? 
1 1 1    7   39   12 o 8.433352 3.833542   17.21075     1.7 -0.5412986 1.413391          ?        ? 
1 1 1    7   39   13 o 25.20389 3.161861   23.96482    45.8   6.916593 1.593824          ?        ? 
1 1 1    7   39   14 o 19.31153 3.794670   14.98040   323.7   4.450677 1.413391          ?        ? 
1 1 1    7   40    0 o 78.48472 1.380327   53.73560    -0.0   61.79826 2.165194   61.79826 2.165194 
1 1 1    7   40    1 o 31.95040 1.741245   24.01564   344.2   10.28467 1.112669          ?        ? 
1 1 1    7   40    2 o 19.19209 2.820426   11.78182   158.7   3.759018 1.082597          ?        ? 
1 1 1    7   40    3 o 39.72808 1.476051   45.46288   261.4   15.87809 1.172814          ?        ? 
1 1 1    7   40    4 o 66.40546 1.154784   53.35837    58.0   44.26620 1.533679          ?        ? 
1 1 1    7   40    5 o 60.34120 1.295758   55.09317   124.9   36.59780 1.563751          ?        ? 
1 1 1    7   40    6 o 42.11462 1.428110   30.01484    62.3   17.86285 1.202886          ?        ? 
1 1 1    7   40    7 o 12.83511 4.074344   8.795344   278.8   1.744184 1.172814          ?        ? 
1 1 1    7   40    8 o 27.74269 2.222131   21.16452    52.6   7.878902 1.232958          ?        ? 
1 1 1    7   40    9 o 28.07158 2.249659   33.01374   313.2   8.089407 1.263030          ?        ? 
1 1 1    7   40   10 o 17.05183 3.634828   14.21715     5.1   3.247792 1.202886          ?        ? 
1 1 1    7   40   11 o 22.26849 2.835913   19.52605   161.4   5.232553 1.263030          ?        ? 
1 1 1    7   40   12 o 27.52412 2.786064   28.18490    54.2   8.089407 1.533679          ?        ? 
1 1 1    7   40   13 o 10.21319 4.231435   15.97231   156.4  0.8119479 1.413391          ?        ? 
1 1 1    7   41    0 o 69.26867 1.586453   91.04444   180.0   48.23572 2.195267   48.23572 2.195267 
1 1 1    7   41    1 o 40.26846 1.530923   25.61276   351.9   16.32917 1.232958          ?        ? 
1 1 1    7   41    2 o 59.84362 1.180903   48.67218    48.2   35.96629 1.413391          ?        ? 
1 1 1    7   41    3 o 51.04551 1.266617   38.44417    30.1   26.19284 1.293102          ?        ? 
1 1 1    7   41    4 o 19.28940 2.728248   14.08012     0.5   3.819162 1.052525          ?        ? 
1 1 1    7   41    5 o 34.90320 1.809333   13.24732    65.6   12.32958 1.263030          ?        ? 
1 1 1    7   41    6 o 37.78902 1.750739   28.27334   349.4   14.46470 1.323174          ?        ? 
1 1 1    7   41    7 o 11.84693 4.173830   7.276682   269.5   1.413391 1.232958          ?        ? 
1 1 1    7   41    8 o 36.34970 1.778697   32.25871   355.2   13.44225 1.293102          ?        ? 
1 1 1    7   41    9 o 10.15760 4.012996   11.41986   136.1  0.7818757 1.202886          ?        ? 
1 1 1    7   41   10 o 47.54016 1.549779   38.86296     8.6   22.97512 1.473535          ?        ? 
1 1 1    7   41   11 o 11.11144 4.252202   17.09003   111.7   1.202886 1.323174          ?        ? 
1 1 1    7   41   12 o 11.48330 4.533029   14.51775   185.4   1.353247 1.533679          ?        ? 
1 1 1    7   41   13 o 25.36171 2.905039   24.53478   193.1   7.127099 1.473535          ?        ? 
1 1 1    7   42    0 o 68.93946 1.484650   62.50470     0.0   47.78464 2.044906   47.78464 2.044906 
1 1 1    7   42    1 o 87.20232 1.103536   71.91940   247.7   76.38325 1.924617          ?        ? 
1 1 1    7   42    2 o 27.82153 1.945610   26.65601    37.0   7.848830 1.082597          ?        ? 
1 1 1    7   42    3 o 44.72379 1.378414   43.76995   129.1   20.14834 1.232958          ?        ? 
1 1 1    7   42    4 f 25.08295 2.277925   15.65275    11.7   6.435439 1.142741          ?        ? 
1 1 1    7   42    5 o 66.68369 1.285256   47.51649   255.8   44.83757 1.714112          ?        ? 
1 1 1    7   42    6 o 26.32295 2.341983   21.94716   192.0   7.127099 1.232958          ?        ? 
1 1 1    7   42    7 f 49.59664 1.485519   45.97216   254.4   24.92981 1.473535          ?        ? 
1 1 1    7   42    8 o 23.05592 2.739058   21.34766   200.3   5.563347 1.263030          ?        ? 
1 1 1    7   42    9 o 12.78074 4.186162   12.30410   211.3   1.834401 1.232958          ?        ? 
1 1 1    7   42   10 o 12.28613 4.186163   9.349742   285.2   1.714112 1.232958          ?        ? 
1 1 1    7   42   11 f 16.52772 4.032948   21.10859   121.0   3.307936 1.323174          ?        ? 
1 1 1    7   42   12 o 25.80736 3.029662   25.16700   151.7   7.427820 1.563751          ?        ? 
1 1 1    7   43    0 o 19.70411 4.661705   16.25069   180.0   4.631110 1.593824   4.631110 1.593824 
1 1 1    7   43    1 o 71.79043 1.193831   57.33305    24.5   51.90452 1.714112          ?        ? 
1 1 1    7   43    2 o 12.73904 3.891176   4.156345   183.5   1.774257 1.082597          ?        ? 
1 1 1    7   43    3 o 25.70264 2.164504   19.48201     8.4   6.766232 1.112669          ?        ? 
1 1 1    7   43    4 o 44.36996 1.457182   41.97029   109.0   19.90776 1.293102          ?        ? 
1 1 1    7   43    5 o 26.53049 2.380337   33.39077    73.4   7.277459 1.263030          ?        ? 
1 1 1    7   43    6 o 51.80107 1.451329   47.65182   219.0   27.18522 1.503607          ?        ? 
1 1 1    7   43    7 o 26.50141 2.496423   22.22133   114.6   7.307531 1.323174          ?        ? 
1 1 1    7   43    8 o 43.79579 1.510618   36.21695   167.3   19.51682 1.323174          ?        ? 
1 1 1    7   43    9 o 8.172750 3.678392   14.31109   175.3 -0.3007214 1.263030          ?        ? 
1 1 1    7   43   10 o 30.25492 2.236408   30.99899   235.5   9.653158 1.353247          ?        ? 
1 1 1    7   43   11 o 11.11614 4.218242   10.49836    65.0   1.383319 1.293102          ?        ? 
1 1 1    7   44    0 o 29.75918 2.826151   22.25734   180.0   9.292293 1.653968   9.292293 1.653968 
1 1 1    7   44    1 o 72.58709 1.160014   56.08736   208.9   53.10741 1.684040          ?        ? 
1 1 1    7   44    2 o 63.09880 1.215300   53.89711   221.7   40.17639 1.533679          ?        ? 
1 1 1    7   44    3 o 62.31097 1.158274   57.07117   307.8   39.15393 1.443463          ?        ? 
1 1 1    7   44    4 o 33.84555 1.732596   13.06508   263.3   11.66799 1.172814          ?        ? 
1 1 1    7   44    5 o 47.32446 1.461526   26.88394   227.9   22.70447 1.383319          ?        ? 
1 1 1    7   44    6 o 27.30924 2.367518   27.76291   233.3   7.758613 1.293102          ?        ? 
1 1 1    7   44    7 o 28.37348 2.331709   24.82740    99.8   8.420200 1.323174          ?        ? 
1 1 1    7   44    8 o 38.44286 1.799188   30.76752   357.5   15.21651 1.383319          ?        ? 
1 1 1    7   44    9 o 7.625513 3.522520   4.134869   273.7 -0.6014429 1.263030          ?        ? 
1 1 1    7   44   10 o 9.707823 4.087614   7.830522   148.3  0.6615872 1.353247          ?        ? 
1 1 1    7   45    0 o 6.379381 4.346957   2.184961   360.0 -0.5713707 1.623896 -0.5713707 1.623896 
1 1 1    7   45    1 o 31.00414 1.891383   29.95330   211.7   9.833591 1.172814          ?        ? 
1 1 1    7   45    2 o 15.75170 3.688485   9.728494   248.4   2.796710 1.142741          ?        ? 
1 1 1    7   45    3 o 22.24089 2.569010   14.64999   305.5   5.172409 1.142741          ?        ? 
1 1 1    7   45    4 o 9.496214 3.789531   12.13333   215.8  0.6615872 1.082597          ?        ? 
1 1 1    7   45    5 o 29.36965 2.150230   26.14292    33.8   8.961499 1.263030          ?        ? 
1 1 1    7   45    6 f 8.879912 3.849199   13.46020   249.1  0.1503607 1.263030          ?        ? 
1 1 1    7   45    7 o 36.01796 2.003810   36.54841   319.2   13.50239 1.443463          ?        ? 
1 1 1    7   45    8 o 43.98954 1.674870   38.64958   248.1   19.99798 1.473535          ?        ? 
1 1 1    7   45    9 o 20.36881 3.248041   22.04046    93.8   4.721327 1.323174          ?        ? 
1 1 1    7   46    0 o 30.29954 2.980609   25.56254   180.0   9.773447 1.774257   9.773447 1.774257 
1 1 1    7   46    1 o 12.80088 4.015752   9.743772   160.1   1.894545 1.142741          ?        ? 
1 1 1    7   46    2 o 9.108246 3.762835   5.828984    23.6  0.4811543 1.112669          ?        ? 
1 1 1    7   46    3 o 21.68354 2.357671   18.53377   223.0   4.931832 1.022453          ?        ? 
1 1 1    7   46    4 o 16.00418 3.568258   23.68068   333.4   2.947070 1.112669          ?        ? 
1 1 1    7   46    5 o 15.33307 4.125596   8.865046   340.4   2.856854 1.293102          ?        ? 
1 1 1    7   46    6 o 6.678915 3.204952   1.719488   280.2  -1.353247 1.232958          ?        ? 
1 1 1    7   46    7 o 8.376926 3.709356   8.276903   346.9       0.03 1.232958          ?        ? 
1 1 1    7   47    0 o 36.36377 2.462534   25.87264   180.0   13.80311 1.774257   13.80311 1.774257 
1 1 1    7   47    1 o 35.29873 1.789059   32.69476    86.2   12.87088 1.263030          ?        ? 
1 1 1    7   47    2 o 31.80214 1.938483   19.12562   254.4   10.52525 1.232958          ?        ? 
1 1 1    7   47    3 o 9.357989 3.797666   10.55712   185.0  0.6916593 1.112669          ?        ? 
1 1 1    7   47    4 o 25.42869 2.246954   17.51388   243.7   6.856449 1.142741          ?        ? 
1 1 1    7   47    5 o 25.15256 2.869416   19.15800   171.4   6.976738 1.443463          ?        ? 
1 1 1    7   48    0 o 60.58749 1.815241   41.03302    -0.0   37.56011 2.195267   37.56011 2.195267 
1 1 1    7   48    1 o 32.42021 1.994284   19.32442   215.2   11.03648 1.293102          ?        ? 
1 1 1    7   48    2 o 9.797653 3.898535   13.16672   331.0  0.9021643 1.142741          ?        ? 
1 1 1    8    0    0 o 15.47344 1.179651   556.9586     0.0   2.435844 0.3608657   2.435844 0.3608657 
1 1 1    8    0    1 o 454.7966 3.825777   398.6883   180.0   2069.986 34.79347   2069.986 34.79347 
1 1 1    8    0    2 o 494.5385 4.102167   459.3614   180.0   2447.993 40.56732   2447.993 40.56732 
1 1 1    8    0    3 o 13.42876 1.019360   60.35285   180.0   1.834401 0.2706493   1.834401 0.2706493 
1 1 1    8    0    4 o 61.22227 0.7616183   76.75242     0.0   37.49996 0.9322364   37.49996 0.9322364 
1 1 1    8    0    5 o 17.49096 1.127140   133.1841   180.0   3.097431 0.3909379   3.097431 0.3909379 
1 1 1    8    0    6 o 64.11372 1.032495   41.13741     0.0   41.13869 1.323174   41.13869 1.323174 
1 1 1    8    0    7 f 46.75280 1.062526   40.20620   180.0   21.89252 0.9923807   21.89252 0.9923807 
1 1 1    8    0    8 o 69.13896 1.175130   23.02833     0.0   47.84478 1.623896   47.84478 1.623896 
1 1 1    8    0    9 o 154.1115 1.873893   205.7364   180.0   237.6301 5.773852   237.6301 5.773852 
1 1 1    8    0   10 o 208.6493 2.335525   238.2975   180.0   435.5950 9.743376   435.5950 9.743376 
1 1 1    8    0   11 o 61.58366 1.319797   121.0019     0.0   37.98112 1.623896   37.98112 1.623896 
1 1 1    8    0   12 o 194.1684 2.207632   210.5166   180.0   377.3152 8.570561   377.3152 8.570561 
1 1 1    8    0   13 o 31.78539 1.713471   91.29163   180.0   10.19446 1.082597   10.19446 1.082597 
1 1 1    8    0   14 o 42.43066 1.456669   66.97726   180.0   18.07336 1.232958   18.07336 1.232958 
1 1 1    8    0   15 o 36.91271 1.636283   26.64240     0.0   13.71290 1.202886   13.71290 1.202886 
1 1 1    8    0   16 o 9.429444 4.728220   49.01492     0.0   1.323174 1.082597   1.323174 1.082597 
1 1 1    8    0   17 o 29.71832 1.991419   40.47628     0.0   8.961499 1.172814   8.961499 1.172814 
1 1 1    8    0   18 o 47.00521 1.797049   45.58632     0.0   22.22332 1.684040   22.22332 1.684040 
1 1 1    8    0   19 o 65.95423 1.369179   38.62789     0.0   43.60461 1.804329   43.60461 1.804329 
1 1 1    8    0   20 o 39.55999 2.607700   51.82967   180.0   15.96831 2.044906   15.96831 2.044906 
1 1 1    8    0   21 o 6.475786 4.324334   9.089218   180.0 -0.3007214 1.473535 -0.3007214 1.473535 
1 1 1    8    0   22 x        ?      ?   60.87214     0.0          ?        ?          ?        ? 
1 1 1    8    0   23 o 26.67213 3.935360   36.75501   180.0   7.728541 2.014834   7.728541 2.014834 
1 1 1    8    0   24 o 8.966872 5.677570   5.512444     0.0  0.9322364 2.135122  0.9322364 2.135122 
1 1 1    8    1    0 o 183.0195 1.774935   33.62879     0.0   335.0939 6.495584   335.0939 6.495584 
1 1 1    8    1    1 o 297.0836 1.882776   245.8624     2.0   882.8279 11.18684          ?        ? 
1 1 1    8    1    2 f 205.6077 1.360217   378.3201    39.8   422.8144 5.593419          ?        ? 
1 1 1    8    1    3 o 147.1084 1.011887   219.4071   246.3   216.4292 2.977142          ?        ? 
1 1 1    8    1    4 o 129.3596 0.9531243   184.4418   214.9   167.3515 2.465916          ?        ? 
1 1 1    8    1    5 o 111.7914 0.8742574   143.3432   194.8   124.9798 1.954689          ?        ? 
1 1 1    8    1    6 o 146.7020 1.076187   182.1943   335.3   215.2263 3.157575          ?        ? 
1 1 1    8    1    7 o 232.4783 1.720416   107.8283   281.9   540.5167 7.999191          ?        ? 
1 1 1    8    1    8 o 396.3049 2.762081   410.5469   127.3   1571.089 21.89252          ?        ? 
1 1 1    8    1    9 o 566.6953 3.810126   731.7277   126.1   3213.840 43.18360          ?        ? 
1 1 1    8    1   10 o 154.2399 1.345293   209.8513    39.2   237.9308 4.149956          ?        ? 
1 1 1    8    1   11 o 170.6249 1.409977   240.6857   156.2   291.1886 4.811543          ?        ? 
1 1 1    8    1   12 o 94.22726 1.005306   55.76517   162.1   88.80304 1.894545          ?        ? 
1 1 1    8    1   13 o 42.43656 1.027525   89.42861    46.1   18.01322 0.8720922          ?        ? 
1 1 1    8    1   14 o 49.55996 0.9405137   31.83446   185.6   24.56894 0.9322364          ?        ? 
1 1 1    8    1   15 o 93.59236 0.9960604   94.38521   292.5   87.63023 1.864473          ?        ? 
1 1 1    8    1   16 o 14.79034 2.439875   4.425900   165.5   2.195267 0.7217315          ?        ? 
1 1 1    8    1   17 o 72.74713 1.012779   75.21568   136.0   52.95705 1.473535          ?        ? 
1 1 1    8    1   18 o 63.92893 1.270079   53.51802   218.2   40.92819 1.623896          ?        ? 
1 1 1    8    1   19 o 36.77690 1.512729   28.09451   141.2   13.56254 1.112669          ?        ? 
1 1 1    8    1   20 o 32.31150 2.233668   37.48024   283.4   10.55532 1.443463          ?        ? 
1 1 1    8    1   21 o 21.74391 1.936220   27.54108   187.8   4.781471 0.8420200          ?        ? 
1 1 1    8    1   22 o 23.20860 2.785826   29.38839    75.4   5.593419 1.293102          ?        ? 
1 1 1    8    1   23 o 45.79070 3.185143   49.20918   128.0   22.31353 2.916998          ?        ? 
1 1 1    8    1   24 o 41.66012 2.273812   34.82361   221.9   18.22372 1.894545          ?        ? 
1 1 1    8    2    0 o 133.2523 1.422136   175.6252   180.0   177.6362 3.789090   177.6362 3.789090 
1 1 1    8    2    1 o 167.4578 1.185231   244.4079    66.9   280.4528 3.969523          ?        ? 
1 1 1    8    2    2 o 235.9003 1.516991   209.9939   219.3   556.6053 7.157170          ?        ? 
1 1 1    8    2    3 o 237.0834 1.484052   327.5474    99.3   562.1987 7.036882          ?        ? 
1 1 1    8    2    4 o 204.4307 1.581346   182.0554   263.8   418.0028 6.465511          ?        ? 
1 1 1    8    2    5 o 188.0578 1.455173   271.0336   204.6   353.7086 5.473131          ?        ? 
1 1 1    8    2    6 o 570.3283 3.485306   756.3293   189.7   3254.528 39.75537          ?        ? 
1 1 1    8    2    7 o 201.1582 1.577172   224.1780    71.7   404.6808 6.345222          ?        ? 
1 1 1    8    2    8 o 185.8023 1.497115   224.7914   279.9   345.2583 5.563347          ?        ? 
1 1 1    8    2    9 o 85.72826 0.8769612   61.47269   353.3   73.49632 1.503607          ?        ? 
1 1 1    8    2   10 o 147.4332 1.264622   231.7186   236.0   217.3915 3.728946          ?        ? 
1 1 1    8    2   11 o 132.7400 1.132746   158.9553   317.7   176.2228 3.007215          ?        ? 
1 1 1    8    2   12 o 329.3148 2.314894   358.3430   298.8   1085.484 15.24658          ?        ? 
1 1 1    8    2   13 o 108.1852 1.028485   95.05386   282.3   117.0709 2.225339          ?        ? 
1 1 1    8    2   14 o 206.0107 1.561918   231.4695   162.1   424.7390 6.435439          ?        ? 
1 1 1    8    2   15 o 33.92702 1.240928   43.29295   269.1   11.51763 0.8420200          ?        ? 
1 1 1    8    2   16 o 101.4382 1.067248   114.9055    42.4   102.9670 2.165194          ?        ? 
1 1 1    8    2   17 o 42.38626 1.206114   38.16967    70.3   17.98314 1.022453          ?        ? 
1 1 1    8    2   18 o 15.79856 3.339027   30.18943   194.5   2.616277 1.022453          ?        ? 
1 1 1    8    2   19 o 82.54786 1.220403   77.77850   251.3   68.26377 2.014834          ?        ? 
1 1 1    8    2   20 o 12.05996 4.181024   6.838241   146.5   1.383319 1.232958          ?        ? 
1 1 1    8    2   21 o 30.60746 1.915895   36.11773   327.0   9.472726 1.172814          ?        ? 
1 1 1    8    2   22 o 48.56989 1.640753   44.67303    24.9   23.90735 1.593824          ?        ? 
1 1 1    8    2   23 o 38.70290 2.913749   41.81966   180.3   15.78788 2.255411          ?        ? 
1 1 1    8    2   24 o 8.986777 3.768811   14.16788   171.2  0.4210100 1.142741          ?        ? 
1 1 1    8    3    0 o 60.42546 0.8962535   111.8389   180.0   36.53765 1.082597   36.53765 1.082597 
1 1 1    8    3    1 o 84.22407 0.7319511   137.9793    94.3   70.94019 1.232958          ?        ? 
1 1 1    8    3    2 o 96.90677 0.8378651   118.9401    52.0   93.91531 1.623896          ?        ? 
1 1 1    8    3    3 o 350.1143 2.276148   483.7325   252.0   1226.372 15.93824          ?        ? 
1 1 1    8    3    4 o 220.1971 1.672973   488.1201   212.0   484.9734 7.367675          ?        ? 
1 1 1    8    3    5 o 343.4112 2.390631   463.5905   189.9   1179.760 16.41939          ?        ? 
1 1 1    8    3    6 o 167.4879 1.328657   343.0586   270.4   280.5431 4.450677          ?        ? 
1 1 1    8    3    7 o 318.9908 2.262547   346.0497   234.9   1017.732 14.43463          ?        ? 
1 1 1    8    3    8 o 244.1681 1.859741   293.9150   243.4   596.2705 9.081788          ?        ? 
1 1 1    8    3    9 o 299.5258 2.158582   347.5802   229.5   897.3829 12.93102          ?        ? 
1 1 1    8    3   10 o 146.9528 1.268757   177.1893   107.6   215.9781 3.728946          ?        ? 
1 1 1    8    3   11 o 78.57009 0.9185830   56.70865     1.8   61.73811 1.443463          ?        ? 
1 1 1    8    3   12 o 65.41124 0.9194794   50.72666   355.7   42.79266 1.202886          ?        ? 
1 1 1    8    3   13 o 137.0611 1.162857   182.9721   321.3   187.9208 3.187647          ?        ? 
1 1 1    8    3   14 o 135.8865 1.172908   170.6885   244.4   184.7332 3.187647          ?        ? 
1 1 1    8    3   15 o 37.58306 1.240235   31.51249    34.5   14.13391 0.9322364          ?        ? 
1 1 1    8    3   16 f 59.14093 1.144086   83.16811    55.9   35.00398 1.353247          ?        ? 
1 1 1    8    3   17 o 93.39616 1.110848   114.3235   105.6   87.29943 2.074978          ?        ? 
1 1 1    8    3   18 o 50.04849 1.171677   59.84291    57.2   25.08017 1.172814          ?        ? 
1 1 1    8    3   19 o 44.02545 1.366125   49.40726    49.9   19.42661 1.202886          ?        ? 
1 1 1    8    3   20 f 10.33115 3.990911   12.49929    55.9  0.7518036 1.172814          ?        ? 
1 1 1    8    3   21 o 44.77469 1.276102   51.79641   236.4   20.14834 1.142741          ?        ? 
1 1 1    8    3   22 o 34.98412 1.848127   31.11708    58.8   12.44987 1.293102          ?        ? 
1 1 1    8    3   23 o 18.69860 4.273030   16.58488   306.7   4.029667 1.563751          ?        ? 
1 1 1    8    3   24 o 15.88047 4.801471   7.247438   183.1   3.217719 1.653968          ?        ? 
1 1 1    8    4    0 o 22.60987 1.001765   30.40403     0.0   5.142337 0.4510822   5.142337 0.4510822 
1 1 1    8    4    1 o 115.5323 1.041168   194.8320    26.9   133.4902 2.405771          ?        ? 
1 1 1    8    4    2 o 181.7542 1.356731   215.4522   179.6   330.4026 4.931832          ?        ? 
1 1 1    8    4    3 o 143.2238 1.102322   161.7253   218.4   205.1522 3.157575          ?        ? 
1 1 1    8    4    4 o 60.27074 0.7484265   298.4616   217.4   36.32715 0.9021643          ?        ? 
1 1 1    8    4    5 o 31.59674 0.8089861   135.1899   158.0   9.983953 0.5112265          ?        ? 
1 1 1    8    4    6 o 247.0562 1.661504   390.3144   256.6   610.4344 8.209695          ?        ? 
1 1 1    8    4    7 o 70.24767 0.7705573   143.6679   153.0   49.34839 1.082597          ?        ? 
1 1 1    8    4    8 o 266.5490 1.968715   275.2799   281.8   710.6048 10.49518          ?        ? 
1 1 1    8    4    9 o 378.1656 2.644077   407.2105   355.8   1430.652 19.99798          ?        ? 
1 1 1    8    4   10 o 235.8810 1.791215   230.2700   275.6   556.5452 8.450273          ?        ? 
1 1 1    8    4   11 o 201.0489 1.607945   267.9346   235.6   404.3200 6.465511          ?        ? 
1 1 1    8    4   12 o 44.74807 1.075252   67.93286   187.4   20.02805 0.9623086          ?        ? 
1 1 1    8    4   13 o 64.73793 0.9987207   63.76019   244.0   41.92057 1.293102          ?        ? 
1 1 1    8    4   14 o 160.2350 1.492019   190.1141    19.1   256.9364 4.781471          ?        ? 
1 1 1    8    4   15 o 92.86378 1.036258   108.5875    57.7   86.27699 1.924617          ?        ? 
1 1 1    8    4   16 o 106.7570 1.169004   122.2210     2.0   114.0636 2.495988          ?        ? 
1 1 1    8    4   17 o 28.25747 1.649540   46.38757    22.6   7.999191 0.9322364          ?        ? 
1 1 1    8    4   18 o 57.29047 1.233531   51.35222    67.5   32.86885 1.413391          ?        ? 
1 1 1    8    4   19 o 40.80029 1.437262   36.17742   223.0   16.69004 1.172814          ?        ? 
1 1 1    8    4   20 o 47.35197 1.428923   41.04100   135.5   22.52404 1.353247          ?        ? 
1 1 1    8    4   21 o 61.03305 1.625973   64.90828    45.2   37.56011 1.984761          ?        ? 
1 1 1    8    4   22 o 23.67957 2.412927   29.06885   239.1   5.773852 1.142741          ?        ? 
1 1 1    8    4   23 o 8.976598 4.008657   11.16606   317.1 -0.3007214 1.473535          ?        ? 
1 1 1    8    4   24 o 10.20423 4.254931   17.69281   278.9  0.7217315 1.443463          ?        ? 
1 1 1    8    5    0 o 337.9170 3.547236   334.7476    -0.0   1142.922 23.96750   1142.922 23.96750 
1 1 1    8    5    1 o 143.2419 1.249140   254.0462   295.1   205.2123 3.578585          ?        ? 
1 1 1    8    5    2 o 440.5547 3.402748   416.3702   288.7   1942.931 29.98193          ?        ? 
1 1 1    8    5    3 o 352.1173 2.498060   589.6038     2.4   1240.506 17.59221          ?        ? 
1 1 1    8    5    4 o 233.6392 1.930679   450.9295   245.7   546.0199 9.021644          ?        ? 
1 1 1    8    5    5 o 249.7220 1.788274   464.6902   108.8   623.7264 8.931427          ?        ? 
1 1 1    8    5    6 o 206.1631 1.546178   312.9321   102.9   425.0698 6.375295          ?        ? 
1 1 1    8    5    7 o 296.0968 2.092174   394.7723   190.7   876.8737 12.38972          ?        ? 
1 1 1    8    5    8 o 302.3698 2.158171   425.0992   238.9   914.4638 13.05131          ?        ? 
1 1 1    8    5    9 o 154.9333 1.271338   187.2609   216.7   240.0659 3.939451          ?        ? 
1 1 1    8    5   10 o 166.0018 1.367724   203.8347   179.4   275.6112 4.540894          ?        ? 
1 1 1    8    5   11 f 127.4917 1.250139   156.6823   307.1   162.5700 3.187647          ?        ? 
1 1 1    8    5   12 o 103.5001 1.118625   84.03121   173.4   107.1470 2.315555          ?        ? 
1 1 1    8    5   13 o 184.8263 1.602643   284.8848     1.3   341.8300 5.924213          ?        ? 
1 1 1    8    5   14 o 160.6398 1.450818   213.5977   303.8   258.2295 4.661182          ?        ? 
1 1 1    8    5   15 o 124.6318 1.254697   138.5946   346.8   155.4429 3.127503          ?        ? 
1 1 1    8    5   16 f 69.34509 0.9974164   68.67754   312.0   48.11543 1.383319          ?        ? 
1 1 1    8    5   17 o 10.02790 3.619543   18.06561   214.1  0.8420200 0.9322364          ?        ? 
1 1 1    8    5   18 o 130.9466 1.423842   121.5699   142.1   171.8022 3.728946          ?        ? 
1 1 1    8    5   19 o 82.60165 1.164999   75.45892   267.6   68.35399 1.924617          ?        ? 
1 1 1    8    5   20 o 29.19547 2.008554   21.47428   298.2   8.600634 1.172814          ?        ? 
1 1 1    8    5   21 o 29.34695 2.459306   25.93942    21.9   8.781067 1.443463          ?        ? 
1 1 1    8    5   22 o 21.92221 3.155062   16.56518   101.9   5.052120 1.383319          ?        ? 
1 1 1    8    5   23 o 10.95139 4.129736   10.68114   151.5   1.112669 1.232958          ?        ? 
1 1 1    8    5   24 o 36.64954 2.256465   41.60614    79.3   14.16398 1.653968          ?        ? 
1 1 1    8    6    0 o 143.2746 2.289125   221.9346   180.0   205.4830 6.555727   205.4830 6.555727 
1 1 1    8    6    1 o 306.2759 2.886681   424.8656   105.7   938.7621 17.68242          ?        ? 
1 1 1    8    6    2 o 152.5141 1.271786   222.4493   197.3   232.6381 3.879307          ?        ? 
1 1 1    8    6    3 o 288.7649 2.114054   533.2573     2.9   834.1412 12.20929          ?        ? 
1 1 1    8    6    4 o 146.1340 1.193552   251.4511    38.7   213.5724 3.488369          ?        ? 
1 1 1    8    6    5 o 457.1603 3.101542   550.3040    51.6   2090.976 28.35803          ?        ? 
1 1 1    8    6    6 o 144.7010 1.070286   197.1948   159.9   209.3923 3.097431          ?        ? 
1 1 1    8    6    7 o 170.5485 1.331262   245.7451   349.3   290.8878 4.540894          ?        ? 
1 1 1    8    6    8 o 355.3466 2.471128   479.1494   357.3   1263.060 17.56213          ?        ? 
1 1 1    8    6    9 o 212.9697 1.680326   188.6928    31.0   453.6383 7.157170          ?        ? 
1 1 1    8    6   10 o 374.0107 2.629227   402.4138   298.5   1399.738 19.66718          ?        ? 
1 1 1    8    6   11 o 113.1900 1.075998   127.4493   252.5   128.1374 2.435844          ?        ? 
1 1 1    8    6   12 o 103.5311 1.016627   99.47411   193.8   107.2072 2.105050          ?        ? 
1 1 1    8    6   13 o 60.11562 0.9254411   111.7203   256.5   36.14672 1.112669          ?        ? 
1 1 1    8    6   14 o 166.6551 1.497697   150.9874   242.8   277.9568 4.991976          ?        ? 
1 1 1    8    6   15 o 100.7673 1.223569   119.3354   225.1   101.6138 2.465916          ?        ? 
1 1 1    8    6   16 o 37.01086 1.381288   62.10560   174.6   13.71290 1.022453          ?        ? 
1 1 1    8    6   17 o 31.94371 1.741609   57.52544   220.1   10.22453 1.112669          ?        ? 
1 1 1    8    6   18 o 100.4880 1.376601   105.4062   261.4   101.1627 2.766637          ?        ? 
1 1 1    8    6   19 o 39.23164 1.724688   40.50206   221.5   15.45708 1.353247          ?        ? 
1 1 1    8    6   20 o 84.04807 1.144950   73.04196   334.3   70.84998 1.924617          ?        ? 
1 1 1    8    6   21 o 31.53329 2.193426   45.81751   111.0   10.10424 1.383319          ?        ? 
1 1 1    8    6   22 o 36.69987 2.089489   45.46220   278.9   13.77304 1.533679          ?        ? 
1 1 1    8    6   23 o 43.96231 1.983727   31.73450    43.1   19.84762 1.744184          ?        ? 
1 1 1    8    6   24 o 31.82507 2.315054   31.18744   164.5   10.73576 1.473535          ?        ? 
1 1 1    8    7    0 f 244.5378 3.426373   252.0098    -0.0   598.6462 16.75019   598.6462 16.75019 
1 1 1    8    7    1 o 72.60222 1.118351   253.3793   112.1   52.71647 1.623896          ?        ? 
1 1 1    8    7    2 f 190.8109 1.709980   296.5965   174.7   364.1737 6.525656          ?        ? 
1 1 1    8    7    3 o 279.6485 2.269000   356.6331   151.7   782.3268 12.69044          ?        ? 
1 1 1    8    7    4 o 162.5577 1.193209   203.8561   305.3   264.2740 3.879307          ?        ? 
1 1 1    8    7    5 o 298.4523 1.969864   349.9949   133.4   890.8873 11.75821          ?        ? 
1 1 1    8    7    6 o 169.6482 1.249696   130.1819   227.4   287.8205 4.240172          ?        ? 
1 1 1    8    7    7 o 192.2075 1.376819   190.5275    33.3   369.4664 5.292697          ?        ? 
1 1 1    8    7    8 o 185.7532 1.473227   144.9284    37.7   345.0779 5.473131          ?        ? 
1 1 1    8    7    9 o 83.91983 0.8958593   46.60316   305.1   70.42896 1.503607          ?        ? 
1 1 1    8    7   10 o 129.3674 1.173900   109.1607    55.1   167.3815 3.037287          ?        ? 
1 1 1    8    7   11 o 236.3733 1.762040   265.5141    96.5   558.9509 8.329985          ?        ? 
1 1 1    8    7   12 o 115.5772 1.092802   106.9533    26.6   133.6105 2.526060          ?        ? 
1 1 1    8    7   13 o 56.45250 0.9588568   31.18272   214.9   31.87647 1.082597          ?        ? 
1 1 1    8    7   14 o 141.5851 1.231899   197.6074   133.5   200.5812 3.488369          ?        ? 
1 1 1    8    7   15 o 43.54807 1.104881   54.00155    91.3   18.97552 0.9623086          ?        ? 
1 1 1    8    7   16 o 67.69498 1.154998   53.25441   124.5   45.86002 1.563751          ?        ? 
1 1 1    8    7   17 o 176.6825 1.616942   197.8233    67.8   312.7202 5.713707          ?        ? 
1 1 1    8    7   18 o 75.28271 1.138450   83.65347   221.9   56.74614 1.714112          ?        ? 
1 1 1    8    7   19 f 41.92390 1.685662   30.34600   350.7   17.65235 1.413391          ?        ? 
1 1 1    8    7   20 o 69.25951 1.150617   74.78162   309.9   48.11543 1.593824          ?        ? 
1 1 1    8    7   21 o 12.22755 4.322221   14.17306   201.0   1.443463 1.323174          ?        ? 
1 1 1    8    7   22 o 25.68728 2.399939   25.36294   196.0   6.796305 1.232958          ?        ? 
1 1 1    8    7   23 o 43.70218 2.098752   37.85873    58.3   19.69725 1.834401          ?        ? 
1 1 1    8    7   24 o 31.87710 2.264107   30.14544   129.9   10.76583 1.443463          ?        ? 
1 1 1    8    8    0 o 397.4089 5.128594   490.8156   180.0   1581.795 40.74776   1581.795 40.74776 
1 1 1    8    8    1 f 287.7242 2.367316   373.8875    62.0   828.2170 13.62268          ?        ? 
1 1 1    8    8    2 o 227.5164 1.942983   391.7932    64.3   517.7822 8.841210          ?        ? 
1 1 1    8    8    3 o 231.6362 1.979829   412.5877   168.8   536.6976 9.172004          ?        ? 
1 1 1    8    8    4 o 327.5520 2.304400   367.1285   115.9   1073.215 15.09622          ?        ? 
1 1 1    8    8    5 f 138.1738 1.055554   171.3755   342.4   190.9281 2.916998          ?        ? 
1 1 1    8    8    6 o 354.6001 2.306718   404.2024   284.7   1257.647 16.35925          ?        ? 
1 1 1    8    8    7 o 199.4392 1.409826   242.2524   134.8   397.7943 5.623491          ?        ? 
1 1 1    8    8    8 o 223.6804 1.667087   218.6023   299.5   500.4005 7.457891          ?        ? 
1 1 1    8    8    9 o 21.86501 1.444122   55.95451   218.9   4.781471 0.6315150          ?        ? 
1 1 1    8    8   10 o 170.1664 1.422613   244.9704    30.7   289.6248 4.841615          ?        ? 
1 1 1    8    8   11 o 92.21238 1.010967   134.9880    88.6   85.04402 1.864473          ?        ? 
1 1 1    8    8   12 o 86.87215 0.9519552   99.70975   297.6   75.48109 1.653968          ?        ? 
1 1 1    8    8   13 o 98.35909 0.9936496   117.2962   202.9   96.77216 1.954689          ?        ? 
1 1 1    8    8   14 o 153.1398 1.286227   176.0960   338.5   234.6830 3.939451          ?        ? 
1 1 1    8    8   15 o 76.69787 0.9606103   94.13290   334.1   58.85118 1.473535          ?        ? 
1 1 1    8    8   16 o 178.1540 1.358828   196.4673    54.5   317.7122 4.841615          ?        ? 
1 1 1    8    8   17 o 68.09150 1.059944   68.36692    72.2   46.40132 1.443463          ?        ? 
1 1 1    8    8   18 o 55.33675 1.304254   74.18429   147.3   30.67359 1.443463          ?        ? 
1 1 1    8    8   19 o 123.5108 1.302606   131.3255   232.2   152.9469 3.217719          ?        ? 
1 1 1    8    8   20 o 7.230461 3.360766   3.503606   215.7 -0.9923807 1.172814          ?        ? 
1 1 1    8    8   21 o 9.750764 4.095793   12.51190   131.8  0.2706493 1.353247          ?        ? 
1 1 1    8    8   22 o 36.97950 2.155010   40.66792   101.8   14.01362 1.593824          ?        ? 
1 1 1    8    8   23 o 34.90693 2.282962   37.35900    45.7   12.66037 1.593824          ?        ? 
1 1 1    8    8   24 o 27.37166 2.526917   32.81269     8.5   8.059335 1.383319          ?        ? 
1 1 1    8    9    0 o 365.5347 4.666353   414.9192   180.0   1337.880 34.10181   1337.880 34.10181 
1 1 1    8    9    1 o 60.49455 0.8450786   150.6452   193.5   36.59780 1.022453          ?        ? 
1 1 1    8    9    2 o 374.8930 2.951922   520.1523   297.1   1406.294 22.13310          ?        ? 
1 1 1    8    9    3 o 196.2028 1.578688   160.7627   205.9   385.0137 6.194862          ?        ? 
1 1 1    8    9    4 o 387.1370 2.734277   344.8019   337.2   1499.247 21.17079          ?        ? 
1 1 1    8    9    5 o 211.3416 1.586552   288.9525   241.1   446.6917 6.706088          ?        ? 
1 1 1    8    9    6 o 456.1824 3.085117   610.9213    53.9   2081.774 28.14753          ?        ? 
1 1 1    8    9    7 f 48.98663 0.7980503   78.75463   342.5   23.99757 0.7818757          ?        ? 
1 1 1    8    9    8 o 164.5151 1.334386   114.5039   183.7   270.6794 4.390533          ?        ? 
1 1 1    8    9    9 o 213.4238 1.641525   251.8426   152.4   455.5930 7.006810          ?        ? 
1 1 1    8    9   10 o 120.2365 1.112982   112.1316    74.0   144.5869 2.676421          ?        ? 
1 1 1    8    9   11 o 139.0809 1.243268   161.6585   124.2   193.4842 3.458297          ?        ? 
1 1 1    8    9   12 o 121.2484 1.128495   168.9255   147.1   147.0528 2.736565          ?        ? 
1 1 1    8    9   13 o 119.6059 1.131421   158.8671   316.8   143.1133 2.706493          ?        ? 
1 1 1    8    9   14 o 80.13081 0.9569848   101.4069   335.5   64.23410 1.533679          ?        ? 
1 1 1    8    9   15 o 97.44112 1.049303   104.6058   273.4   94.99790 2.044906          ?        ? 
1 1 1    8    9   16 o 92.71549 0.9568285   113.8839   206.6   86.00633 1.774257          ?        ? 
1 1 1    8    9   17 o 76.41200 0.9838816   92.60168   181.9   58.43018 1.503607          ?        ? 
1 1 1    8    9   18 o 48.20828 1.185213   34.30196    71.7   23.27584 1.142741          ?        ? 
1 1 1    8    9   19 o 43.94744 1.334337   38.62760   207.7   19.36646 1.172814          ?        ? 
1 1 1    8    9   20 o 39.60396 2.012203   48.24424    21.4   15.84802 1.593824          ?        ? 
1 1 1    8    9   21 o 39.69342 2.045548   39.83063   122.9   15.99838 1.623896          ?        ? 
1 1 1    8    9   22 o 19.09652 3.674279   9.038718   241.5   4.029667 1.353247          ?        ? 
1 1 1    8    9   23 o 27.93047 2.368694   30.36073   260.4   8.149551 1.323174          ?        ? 
1 1 1    8    9   24 o 27.45155 2.957749   25.21004    31.5   8.329985 1.623896          ?        ? 
1 1 1    8   10    0 o 184.1726 2.188677   84.47172     0.0   339.3942 8.059335   339.3942 8.059335 
1 1 1    8   10    1 o 298.0027 2.492535   260.0935   238.5   888.4214 14.85564          ?        ? 
1 1 1    8   10    2 f 218.2080 1.908725   214.3658    52.0   476.2525 8.329985          ?        ? 
1 1 1    8   10    3 o 302.0710 2.234970   438.6472    63.7   912.6896 13.50239          ?        ? 
1 1 1    8   10    4 o 191.2976 1.493408   224.9448   241.0   365.9780 5.713707          ?        ? 
1 1 1    8   10    5 o 268.2911 1.961536   248.8805   335.2   719.8970 10.52525          ?        ? 
1 1 1    8   10    6 o 44.51624 0.8444151   18.60529    94.9   19.81754 0.7518036          ?        ? 
1 1 1    8   10    7 o 427.6733 2.988417   477.1064   352.3   1829.800 25.56132          ?        ? 
1 1 1    8   10    8 o 186.7206 1.393119   232.5956    17.7   348.6865 5.202481          ?        ? 
1 1 1    8   10    9 o 129.6469 1.159771   149.2652   359.4   168.1033 3.007215          ?        ? 
1 1 1    8   10   10 o 132.4891 1.191636   121.8503   277.3   175.5612 3.157575          ?        ? 
1 1 1    8   10   11 o 117.9846 1.108737   118.7880   115.8   139.2340 2.616277          ?        ? 
1 1 1    8   10   12 o 182.8730 1.504651   216.7782   216.5   334.6127 5.503202          ?        ? 
1 1 1    8   10   13 f 104.2281 1.139664   127.1501   251.1   108.6807 2.375700          ?        ? 
1 1 1    8   10   14 o 84.77874 0.9931972   93.32251   160.9   71.90250 1.684040          ?        ? 
1 1 1    8   10   15 o 102.7205 1.097839   89.19310    92.9   105.5833 2.255411          ?        ? 
1 1 1    8   10   16 o 72.49758 1.078485   66.42793    75.1   52.59618 1.563751          ?        ? 
1 1 1    8   10   17 o 11.22176 3.639640   14.15833   233.1   1.232958 0.9322364          ?        ? 
1 1 1    8   10   18 o 73.71065 1.019939   63.90065   148.8   54.40051 1.503607          ?        ? 
1 1 1    8   10   19 o 21.15875 2.131894   32.10762   292.4   4.510822 0.9021643          ?        ? 
1 1 1    8   10   20 o 30.58851 1.474678   32.83628    67.1   9.412581 0.9021643          ?        ? 
1 1 1    8   10   21 o 18.23189 3.250751   15.64339   185.3   3.548513 1.142741          ?        ? 
1 1 1    8   10   22 o 15.18963 3.930461   3.557686   203.5   2.616277 1.202886          ?        ? 
1 1 1    8   10   23 o 42.43613 1.488154   39.43483   294.9   18.34401 1.263030          ?        ? 
1 1 1    8   10   24 o 32.22667 2.146233   27.63723     8.3   10.97633 1.383319          ?        ? 
1 1 1    8   11    0 o 147.5785 1.956967   77.39362   180.0   217.9328 5.773852   217.9328 5.773852 
1 1 1    8   11    1 o 555.5753 4.230099   632.5179   262.2   3089.642 47.00276          ?        ? 
1 1 1    8   11    2 o 74.48566 0.8680210   79.50953   217.1   55.48311 1.293102          ?        ? 
1 1 1    8   11    3 o 380.1216 2.689805   554.3373   180.8   1445.328 20.44906          ?        ? 
1 1 1    8   11    4 o 323.9746 2.311281   421.6869   202.4   1049.788 14.97593          ?        ? 
1 1 1    8   11    5 o 128.5332 1.169820   165.4570   314.1   165.2164 3.007215          ?        ? 
1 1 1    8   11    6 o 198.8857 1.587633   229.8881   195.4   395.5991 6.315150          ?        ? 
1 1 1    8   11    7 f 210.3234 1.651425   253.5069   309.4   442.4214 6.946666          ?        ? 
1 1 1    8   11    8 o 112.8611 1.052488   123.2991   140.6   127.3856 2.375700          ?        ? 
1 1 1    8   11    9 o 199.2651 1.584610   218.9218   306.9   397.1628 6.315150          ?        ? 
1 1 1    8   11   10 o 31.59438 1.237365   18.87993   200.1   9.983953 0.7818757          ?        ? 
1 1 1    8   11   11 o 147.9492 1.280538   220.1539   235.8   218.9553 3.789090          ?        ? 
1 1 1    8   11   12 o 145.2760 1.262700   159.8916   160.6   211.1365 3.668802          ?        ? 
1 1 1    8   11   13 o 176.3095 1.466855   220.6795   133.6   311.0663 5.172409          ?        ? 
1 1 1    8   11   14 o 88.20060 1.005808   104.8077     4.2   77.82671 1.774257          ?        ? 
1 1 1    8   11   15 o 99.16422 1.015908   110.3509    61.8   98.39606 2.014834          ?        ? 
1 1 1    8   11   16 o 134.1593 1.221631   150.2372   338.3   180.1622 3.277864          ?        ? 
1 1 1    8   11   17 o 81.33758 1.035217   91.42410   161.6   66.21886 1.684040          ?        ? 
1 1 1    8   11   18 o 19.47916 2.315717   13.52682   143.7   3.819162 0.9021643          ?        ? 
1 1 1    8   11   19 o 23.10255 2.082690   37.58338   202.1   5.382914 0.9623086          ?        ? 
1 1 1    8   11   20 f 37.01707 1.340437   48.13243   332.6   13.77304 0.9923807          ?        ? 
1 1 1    8   11   21 o 23.16832 2.206575   26.28648   307.8   5.473131 1.022453          ?        ? 
1 1 1    8   11   22 o 43.34826 1.526214   40.91941   288.9   19.06574 1.323174          ?        ? 
1 1 1    8   11   23 o 9.488812 3.819467   8.709220   340.9  0.6615872 1.112669          ?        ? 
1 1 1    8   11   24 o 18.86785 3.636185   15.40341   307.1   4.240172 1.323174          ?        ? 
1 1 1    8   12    0 o 103.1426 1.487643   99.06425     0.0   106.4554 3.067359   106.4554 3.067359 
1 1 1    8   12    1 o 357.4689 2.670975   540.0839   326.6   1278.217 19.09581          ?        ? 
1 1 1    8   12    2 o 268.9483 2.051785   311.4054   320.3   723.4456 11.03648          ?        ? 
1 1 1    8   12    3 o 520.6862 3.557698   577.4799   287.4   2712.327 37.04888          ?        ? 
1 1 1    8   12    4 o 577.1400 3.868831   658.1635   261.5   3332.685 44.65714          ?        ? 
1 1 1    8   12    5 o 476.1837 3.299713   570.7704    68.1   2268.552 31.42539          ?        ? 
1 1 1    8   12    6 o 450.6817 3.112763   412.0038   297.9   2032.035 28.05731          ?        ? 
1 1 1    8   12    7 o 179.7874 1.471932   188.4058   132.3   323.2755 5.292697          ?        ? 
1 1 1    8   12    8 o 281.4793 2.120696   297.3741   218.3   792.5815 11.93864          ?        ? 
1 1 1    8   12    9 o 202.1481 1.777717   284.0787   188.4   408.7707 7.187243          ?        ? 
1 1 1    8   12   10 o 47.45565 1.045587   76.47662   269.3   22.52404 0.9923807          ?        ? 
1 1 1    8   12   11 o 124.4443 1.135762   145.1250    60.7   154.9016 2.826782          ?        ? 
1 1 1    8   12   12 o 141.4915 1.253967   183.0817    11.0   200.2805 3.548513          ?        ? 
1 1 1    8   12   13 o 107.9400 1.072612   105.5869    29.0   116.5596 2.315555          ?        ? 
1 1 1    8   12   14 o 105.9820 1.035679   146.1740     9.0   112.3796 2.195267          ?        ? 
1 1 1    8   12   15 o 147.4333 1.366607   165.3610   141.0   217.6020 4.029667          ?        ? 
1 1 1    8   12   16 o 181.2722 1.493055   186.2403   113.2   329.0795 5.412986          ?        ? 
1 1 1    8   12   17 o 48.85725 1.292572   59.41781   152.7   23.90735 1.263030          ?        ? 
1 1 1    8   12   18 o 72.39127 1.059299   65.80228    37.3   52.47589 1.533679          ?        ? 
1 1 1    8   12   19 o 22.82945 2.107604   18.54533   304.6   5.262625 0.9623086          ?        ? 
1 1 1    8   12   20 o 24.49910 2.025341   21.57631    33.5   6.074574 0.9923807          ?        ? 
1 1 1    8   12   21 o 13.67741 3.414769   21.69138   348.5   2.044906 0.9322364          ?        ? 
1 1 1    8   12   22 o 21.35309 2.394156   24.83358    62.5   4.721327 1.022453          ?        ? 
1 1 1    8   12   23 o 30.19782 1.991677   26.38623    93.4   9.442654 1.202886          ?        ? 
1 1 1    8   13    0 o 152.4557 2.101626   362.2467   180.0   232.5780 6.405366   232.5780 6.405366 
1 1 1    8   13    1 o 278.4664 2.149041   280.2004   213.0   775.5606 11.96871          ?        ? 
1 1 1    8   13    2 o 81.76089 0.9195150   156.7041   324.0   66.85038 1.503607          ?        ? 
1 1 1    8   13    3 o 460.0044 3.196769   502.3756   324.0   2116.808 29.41056          ?        ? 
1 1 1    8   13    4 o 464.6140 3.223306   523.0365    45.9   2159.571 29.95186          ?        ? 
1 1 1    8   13    5 o 187.2847 1.525407   185.0245    25.9   350.7916 5.713707          ?        ? 
1 1 1    8   13    6 o 124.6716 1.266357   37.22955   242.1   155.4429 3.157575          ?        ? 
1 1 1    8   13    7 o 133.8367 1.235811   79.70895   179.2   179.1398 3.307936          ?        ? 
1 1 1    8   13    8 o 8.600727 3.228665   26.11366   243.5  0.5412986 0.7518036          ?        ? 
1 1 1    8   13    9 o 82.72546 1.108728   13.62830   200.9   68.44421 1.834401          ?        ? 
1 1 1    8   13   10 o 118.5284 1.243192   165.9616   314.3   140.5271 2.947070          ?        ? 
1 1 1    8   13   11 o 25.00375 1.503381   32.21692   117.2   6.255006 0.7518036          ?        ? 
1 1 1    8   13   12 o 73.92878 0.9965910   74.05833   319.5   54.67116 1.473535          ?        ? 
1 1 1    8   13   13 o 25.99524 1.735249   23.88613   327.8   6.766232 0.9021643          ?        ? 
1 1 1    8   13   14 o 88.38419 1.037743   98.78300   350.6   78.15750 1.834401          ?        ? 
1 1 1    8   13   15 o 18.07581 2.412319   26.12610   351.0   3.277864 0.8720922          ?        ? 
1 1 1    8   13   16 o 25.45592 1.890147   12.06693     0.3   6.495584 0.9623086          ?        ? 
1 1 1    8   13   17 o 55.73125 1.079184   76.89819   238.2   31.09460 1.202886          ?        ? 
1 1 1    8   13   18 o 77.60609 1.084992   71.50716   159.4   60.32472 1.684040          ?        ? 
1 1 1    8   13   19 o 37.55749 1.361184   49.30877    57.0   14.16398 1.022453          ?        ? 
1 1 1    8   13   20 o 33.73486 1.470854   32.84177   354.5   11.45749 0.9923807          ?        ? 
1 1 1    8   13   21 o 17.56808 2.909973   22.79873    66.4   3.217719 1.022453          ?        ? 
1 1 1    8   13   22 o 34.25299 1.668090   32.55658   351.1   11.93864 1.142741          ?        ? 
1 1 1    8   13   23 f 8.398253 3.516604   3.364910     9.1  0.3307936 0.9923807          ?        ? 
1 1 1    8   14    0 o 121.1272 1.701395   84.40679   180.0   146.8122 4.119884   146.8122 4.119884 
1 1 1    8   14    1 o 426.5616 2.819958   407.9157   174.8   1820.056 24.05772          ?        ? 
1 1 1    8   14    2 o 389.7103 2.619765   365.3619   186.2   1519.125 20.41899          ?        ? 
1 1 1    8   14    3 o 462.8049 3.226159   445.6266   128.5   2142.791 29.86164          ?        ? 
1 1 1    8   14    4 o 443.7867 3.150961   344.1275    75.4   1970.327 27.96709          ?        ? 
1 1 1    8   14    5 o 163.9112 1.421862   139.4774   265.2   268.6946 4.661182          ?        ? 
1 1 1    8   14    6 o 328.3295 2.372216   358.7101   123.3   1078.357 15.57737          ?        ? 
1 1 1    8   14    7 o 33.44415 1.438680   56.65440   350.0   11.18684 0.9623086          ?        ? 
1 1 1    8   14    8 o 246.4635 1.927831   297.4331    12.8   607.6678 9.502798          ?        ? 
1 1 1    8   14    9 o 195.5653 1.568458   271.6183   323.6   382.5778 6.134717          ?        ? 
1 1 1    8   14   10 o 55.86345 1.157378   45.93676    55.6   31.21489 1.293102          ?        ? 
1 1 1    8   14   11 o 16.70997 2.519514   16.84976   260.1   2.796710 0.8420200          ?        ? 
1 1 1    8   14   12 o 250.1335 1.863478   290.9137   301.2   626.3727 9.322365          ?        ? 
1 1 1    8   14   13 o 40.36135 1.154863   50.32227    73.9   16.29910 0.9322364          ?        ? 
1 1 1    8   14   14 f 122.2990 1.155684   115.9331   202.7   149.6691 2.826782          ?        ? 
1 1 1    8   14   15 o 19.20050 2.427635   35.46909   268.5   3.698874 0.9322364          ?        ? 
1 1 1    8   14   16 o 23.99171 2.068175   21.59085   148.8   5.773852 0.9923807          ?        ? 
1 1 1    8   14   17 o 135.0543 1.447336   138.5111    37.9   182.7785 3.909379          ?        ? 
1 1 1    8   14   18 o 9.884438 3.709673   18.21850   226.9  0.7518036 0.9923807          ?        ? 
1 1 1    8   14   19 o 31.33426 1.823470   34.96704   265.7   9.893736 1.142741          ?        ? 
1 1 1    8   14   20 o 54.98761 1.148468   66.80642   204.3   30.37287 1.263030          ?        ? 
1 1 1    8   14   21 o 7.113026 3.205585   11.13153   331.8 -0.3909379 0.9623086          ?        ? 
1 1 1    8   14   22 o 11.99020 3.600631   4.242049   185.9   1.593824 0.9322364          ?        ? 
1 1 1    8   14   23 o 19.07123 2.680616   18.01213   159.9   3.909379 1.022453          ?        ? 
1 1 1    8   15    0 o 397.6452 4.096100   451.0795   180.0   1582.246 32.56813   1582.246 32.56813 
1 1 1    8   15    1 o 384.2327 2.606240   405.7266    64.6   1476.753 20.02805          ?        ? 
1 1 1    8   15    2 o 320.2931 2.220486   445.4493   303.5   1026.092 14.22412          ?        ? 
1 1 1    8   15    3 o 31.06889 0.9679182   82.56758   285.4   9.653158 0.6014429          ?        ? 
1 1 1    8   15    4 o 222.6562 1.769298   320.9995   190.6   495.8295 7.878902          ?        ? 
1 1 1    8   15    5 o 601.7010 4.080749   625.3879   200.2   3623.784 49.10781          ?        ? 
1 1 1    8   15    6 o 241.8318 1.896360   278.7414    75.3   584.9633 9.172004          ?        ? 
1 1 1    8   15    7 o 333.7626 2.464246   281.5989   213.0   1114.594 16.44946          ?        ? 
1 1 1    8   15    8 o 179.6013 1.506945   227.3528   215.5   322.6440 5.412986          ?        ? 
1 1 1    8   15    9 o 194.5161 1.600108   176.5246   169.5   378.5181 6.224934          ?        ? 
1 1 1    8   15   10 f 63.13963 1.119258   83.05384   286.9   39.87567 1.413391          ?        ? 
1 1 1    8   15   11 o 97.20386 1.129208   111.1776   146.8   94.51675 2.195267          ?        ? 
1 1 1    8   15   12 o 59.22856 1.091621   43.80083   121.4   35.09419 1.293102          ?        ? 
1 1 1    8   15   13 o 72.90142 0.9693850   79.10834   214.7   53.16755 1.413391          ?        ? 
1 1 1    8   15   14 o 86.59125 1.059230   88.77936    83.0   75.03000 1.834401          ?        ? 
1 1 1    8   15   15 o 184.7009 1.489760   188.9343    16.4   341.6196 5.503202          ?        ? 
1 1 1    8   15   16 o 124.3023 1.209637   119.0123     5.5   154.6911 3.007215          ?        ? 
1 1 1    8   15   17 o 73.33257 1.148221   76.48261    35.4   53.85921 1.684040          ?        ? 
1 1 1    8   15   18 o 7.781233 3.417817   23.09574    53.1 -0.2405772 1.022453          ?        ? 
1 1 1    8   15   19 o 59.18402 1.194065   64.60303   139.9   35.15434 1.413391          ?        ? 
1 1 1    8   15   20 o 17.86937 2.692621   21.36831    69.5   3.277864 0.9623086          ?        ? 
1 1 1    8   15   21 o 22.23319 2.299384   31.76192   320.6   5.082192 1.022453          ?        ? 
1 1 1    8   15   22 o 19.85209 2.499436   15.55850    80.5   4.119884 0.9923807          ?        ? 
1 1 1    8   15   23 o 9.378839 3.701548   7.315002    65.3  0.7818757 1.022453          ?        ? 
1 1 1    8   16    0 o 230.1411 2.738371   258.4434   180.0   529.9614 12.60023   529.9614 12.60023 
1 1 1    8   16    1 o 205.3057 1.589253   140.3724   143.3   421.5513 6.525656          ?        ? 
1 1 1    8   16    2 o 305.1848 2.177679   322.3480    28.1   931.5749 13.29189          ?        ? 
1 1 1    8   16    3 o 403.2693 2.680823   349.7937   356.1   1626.813 21.62187          ?        ? 
1 1 1    8   16    4 o 66.77957 0.8781230   101.9508   342.7   44.59699 1.172814          ?        ? 
1 1 1    8   16    5 o 155.0085 1.416223   96.07288   347.5   240.3065 4.390533          ?        ? 
1 1 1    8   16    6 o 103.0115 1.123930   85.87971   243.1   106.1246 2.315555          ?        ? 
1 1 1    8   16    7 o 101.2882 1.128208   73.23354   140.7   102.6062 2.285483          ?        ? 
1 1 1    8   16    8 f 50.28622 1.076435   55.87077   315.3   25.29067 1.082597          ?        ? 
1 1 1    8   16    9 o 213.0575 1.729035   257.3155   116.8   454.1796 7.367675          ?        ? 
1 1 1    8   16   10 o 31.39729 1.580361   72.51898   168.8   9.863664 0.9923807          ?        ? 
1 1 1    8   16   11 o 13.20445 3.641803   15.38506   299.9   1.804329 0.9923807          ?        ? 
1 1 1    8   16   12 o 207.7915 1.874159   232.1733   163.3   432.4074 7.788685          ?        ? 
1 1 1    8   16   13 o 46.64098 1.321754   39.19396   260.1   21.77223 1.232958          ?        ? 
1 1 1    8   16   14 o 18.23582 2.556058   33.34593   142.5   3.338008 0.9322364          ?        ? 
1 1 1    8   16   15 o 120.5445 1.247347   128.7941    38.6   145.4590 3.007215          ?        ? 
1 1 1    8   16   16 o 30.78649 1.709394   10.80185   309.7   9.502798 1.052525          ?        ? 
1 1 1    8   16   17 o 44.73729 1.344388   54.21435   123.4   20.05812 1.202886          ?        ? 
1 1 1    8   16   18 o 33.63263 1.609445   30.23195   142.0   11.36727 1.082597          ?        ? 
1 1 1    8   16   19 o 32.86206 1.692939   28.01276    87.3   10.88612 1.112669          ?        ? 
1 1 1    8   16   20 o 23.58219 2.422891   22.37317   287.7   5.683635 1.142741          ?        ? 
1 1 1    8   16   21 o 19.87715 2.420640   22.84346   138.7   4.089812 0.9623086          ?        ? 
1 1 1    8   16   22 o 17.15245 3.273148   20.59083   322.3   3.277864 1.082597          ?        ? 
1 1 1    8   16   23 f 10.20264 3.939797   15.17273    64.1   1.052525 1.142741          ?        ? 
1 1 1    8   17    0 o 366.7697 3.391016   440.0669     0.0   1345.909 24.86966   1345.909 24.86966 
1 1 1    8   17    1 o 361.2213 2.476727   368.0803   291.8   1305.191 17.89293          ?        ? 
1 1 1    8   17    2 o 289.9897 2.037720   270.1260    92.6   841.1179 11.81835          ?        ? 
1 1 1    8   17    3 o 293.5610 2.064149   315.8135   109.0   861.9879 12.11907          ?        ? 
1 1 1    8   17    4 o 56.37769 0.9601291   93.94347    24.5   31.78626 1.082597          ?        ? 
1 1 1    8   17    5 o 100.1413 1.005995   105.7976   339.2   100.2906 2.014834          ?        ? 
1 1 1    8   17    6 o 406.7297 2.946367   398.2917   321.8   1655.682 23.96750          ?        ? 
1 1 1    8   17    7 f 92.24593 1.092099   132.3625   288.5   85.10417 2.014834          ?        ? 
1 1 1    8   17    8 f 92.12881 1.109808   79.41010     7.2   84.89366 2.044906          ?        ? 
1 1 1    8   17    9 o 201.6835 1.640162   222.4307    81.5   406.9663 6.615872          ?        ? 
1 1 1    8   17   10 o 31.34862 1.582814   63.19223    96.2   9.833591 0.9923807          ?        ? 
1 1 1    8   17   11 o 81.68860 1.178021   93.15595   310.4   66.76016 1.924617          ?        ? 
1 1 1    8   17   12 o 74.38490 1.192619   69.00522   188.1   55.36282 1.774257          ?        ? 
1 1 1    8   17   13 o 38.09113 1.500010   30.80255    84.4   14.52485 1.142741          ?        ? 
1 1 1    8   17   14 o 75.82143 1.110530   111.6420     8.4   57.52802 1.684040          ?        ? 
1 1 1    8   17   15 o 90.02333 1.068955   88.06738   273.3   81.10458 1.924617          ?        ? 
1 1 1    8   17   16 o 62.36617 1.133139   54.42212   119.8   38.94343 1.413391          ?        ? 
1 1 1    8   17   17 o 28.37980 1.854356   33.95515   276.9   8.089407 1.052525          ?        ? 
1 1 1    8   17   18 o 29.93392 1.758081   23.83420   159.8   9.021644 1.052525          ?        ? 
1 1 1    8   17   19 o 19.73022 2.591084   18.67684   219.1   3.969523 1.022453          ?        ? 
1 1 1    8   17   20 o 13.18629 3.860517   13.01460   176.2   1.894545 1.082597          ?        ? 
1 1 1    8   17   21 o 6.230563 2.954791   6.360346   334.5  -1.082597 0.9923807          ?        ? 
1 1 1    8   17   22 o 28.22934 1.864240   28.66967    35.7   8.209695 1.052525          ?        ? 
1 1 1    8   17   23 o 11.16830 4.056975   16.41107   224.6   1.443463 1.172814          ?        ? 
1 1 1    8   18    0 o 121.8879 1.530203   44.12224   180.0   148.6466 3.728946   148.6466 3.728946 
1 1 1    8   18    1 o 99.67564 1.025780   62.95254   297.7   99.35837 2.044906          ?        ? 
1 1 1    8   18    2 f 211.8171 1.632681   263.9214   142.6   448.7365 6.916593          ?        ? 
1 1 1    8   18    3 o 346.4192 2.326469   347.3243    69.8   1200.480 16.11867          ?        ? 
1 1 1    8   18    4 o 244.1710 1.724243   253.0010   178.6   596.3306 8.420200          ?        ? 
1 1 1    8   18    5 o 385.8034 2.580039   289.6691   260.3   1489.383 19.90776          ?        ? 
1 1 1    8   18    6 o 40.07007 1.200782   70.24908   157.0   16.05853 0.9623086          ?        ? 
1 1 1    8   18    7 o 95.58899 1.164014   118.5911   326.3   91.38924 2.225339          ?        ? 
1 1 1    8   18    8 o 227.1922 1.866337   261.5452    90.3   516.4891 8.480345          ?        ? 
1 1 1    8   18    9 o 179.5057 1.566383   181.8325     3.8   322.4034 5.623491          ?        ? 
1 1 1    8   18   10 o 45.47461 1.322591   67.09218   132.6   20.68964 1.202886          ?        ? 
1 1 1    8   18   11 o 42.56876 1.377552   49.01869    63.5   18.13350 1.172814          ?        ? 
1 1 1    8   18   12 o 97.32684 1.220475   96.63241    60.9   94.78741 2.375700          ?        ? 
1 1 1    8   18   13 o 100.4320 1.212683   133.9688   218.4   100.9522 2.435844          ?        ? 
1 1 1    8   18   14 o 123.2809 1.292839   116.0454   268.4   152.1350 3.187647          ?        ? 
1 1 1    8   18   15 o 60.24086 1.173116   45.35967   248.7   36.32715 1.413391          ?        ? 
1 1 1    8   18   16 o 54.77378 1.152951   54.43011   229.1   30.04207 1.263030          ?        ? 
1 1 1    8   18   17 f 44.82804 1.308125   37.97003   347.4   20.14834 1.172814          ?        ? 
1 1 1    8   18   18 o 34.18794 1.627283   39.62333    82.5   11.75821 1.112669          ?        ? 
1 1 1    8   18   19 o 49.18115 1.345205   55.55537   165.0   24.32837 1.323174          ?        ? 
1 1 1    8   18   20 o 54.71856 1.291510   49.29611   276.8   30.19243 1.413391          ?        ? 
1 1 1    8   18   21 f 40.13742 1.573382   38.72138   288.9   16.35925 1.263030          ?        ? 
1 1 1    8   18   22 o 34.71046 1.602787   35.83862   153.0   12.32958 1.112669          ?        ? 
1 1 1    8   19    0 o 579.9627 5.040856   596.0219     0.0   3367.118 58.46025   3367.118 58.46025 
1 1 1    8   19    1 o 370.9200 2.590329   481.9750   353.9   1376.432 19.21610          ?        ? 
1 1 1    8   19    2 o 61.87022 0.9721041   112.4400   117.7   38.28184 1.202886          ?        ? 
1 1 1    8   19    3 o 157.2128 1.291161   138.7847   256.6   247.1930 4.059740          ?        ? 
1 1 1    8   19    4 o 227.1606 1.674641   248.6512   121.5   516.1583 7.608253          ?        ? 
1 1 1    8   19    5 o 180.2729 1.409583   213.8082    70.7   325.0498 5.082192          ?        ? 
1 1 1    8   19    6 o 167.5993 1.408516   198.9383   256.9   280.9641 4.721327          ?        ? 
1 1 1    8   19    7 o 65.13419 0.9926448   47.16674   195.6   42.43180 1.293102          ?        ? 
1 1 1    8   19    8 o 257.1051 2.041029   206.8450   336.8   661.5571 10.49518          ?        ? 
1 1 1    8   19    9 o 10.33680 3.577134   28.75795   255.6  0.9623086 0.9021643          ?        ? 
1 1 1    8   19   10 o 45.14412 1.165739   55.40577   349.8   20.38891 1.052525          ?        ? 
1 1 1    8   19   11 o 65.89870 1.232115   97.10918   157.7   43.45425 1.623896          ?        ? 
1 1 1    8   19   12 f 89.87742 1.187797   107.2363   352.4   80.83392 2.135122          ?        ? 
1 1 1    8   19   13 o 146.2756 1.480216   158.8832   214.6   214.2340 4.330389          ?        ? 
1 1 1    8   19   14 f 121.8805 1.270684   111.0800   231.0   148.7068 3.097431          ?        ? 
1 1 1    8   19   15 o 57.13154 1.315917   61.85860   154.2   32.68842 1.503607          ?        ? 
1 1 1    8   19   16 o 74.00141 1.158162   71.15540   171.9   54.85159 1.714112          ?        ? 
1 1 1    8   19   17 o 39.48285 1.409054   39.94099   306.5   15.63752 1.112669          ?        ? 
1 1 1    8   19   18 o 36.09060 1.624819   48.32403   122.7   13.11145 1.172814          ?        ? 
1 1 1    8   19   19 o 44.76030 1.410882   48.84759   188.8   20.17841 1.263030          ?        ? 
1 1 1    8   19   20 o 19.59312 2.839440   17.62851   194.5   3.999595 1.112669          ?        ? 
1 1 1    8   19   21 o 22.78896 2.507226   20.61215   318.1   5.412986 1.142741          ?        ? 
1 1 1    8   19   22 o 7.087681 3.250420   12.79714   295.4 -0.5112265 1.052525          ?        ? 
1 1 1    8   20    0 o 121.9620 1.479908   144.4339   180.0   148.8270 3.608657   148.8270 3.608657 
1 1 1    8   20    1 o 279.5160 2.022626   276.1785    42.2   781.5750 11.30713          ?        ? 
1 1 1    8   20    2 o 121.5796 1.162523   118.9579    37.0   147.8347 2.826782          ?        ? 
1 1 1    8   20    3 o 111.8014 1.075913   93.09645   230.5   125.0099 2.405771          ?        ? 
1 1 1    8   20    4 o 313.6194 2.224587   273.1690    65.6   984.0808 13.95348          ?        ? 
1 1 1    8   20    5 o 153.3451 1.284505   171.1392    77.1   235.1942 3.939451          ?        ? 
1 1 1    8   20    6 o 109.0607 1.089164   77.63319    77.2   118.9654 2.375700          ?        ? 
1 1 1    8   20    7 o 122.1151 1.157425   116.7588    70.2   149.1578 2.826782          ?        ? 
1 1 1    8   20    8 o 76.35218 0.9649595   108.3610   232.7   58.30989 1.473535          ?        ? 
1 1 1    8   20    9 o 49.79960 1.147340   57.83081    28.2   24.80952 1.142741          ?        ? 
1 1 1    8   20   10 o 130.9930 1.216724   144.6380    96.4   171.6819 3.187647          ?        ? 
1 1 1    8   20   11 o 44.02615 1.297799   54.03641    22.6   19.39653 1.142741          ?        ? 
1 1 1    8   20   12 o 87.58717 1.218856   101.3514   266.3   76.77419 2.135122          ?        ? 
1 1 1    8   20   13 o 84.37183 1.176199   81.39887   257.8   71.24091 1.984761          ?        ? 
1 1 1    8   20   14 o 143.5175 1.445801   145.3562   286.0   206.2648 4.149956          ?        ? 
1 1 1    8   20   15 o 19.76064 3.043641   8.167000     9.8   3.939451 1.202886          ?        ? 
1 1 1    8   20   16 o 26.50963 2.155333   31.89830   346.6   7.066954 1.142741          ?        ? 
1 1 1    8   20   17 o 18.99476 2.849725   23.24921   247.8   3.668802 1.082597          ?        ? 
1 1 1    8   20   18 o 38.68297 1.554800   32.41019    81.2   15.06614 1.202886          ?        ? 
1 1 1    8   20   19 o 56.93144 1.241310   61.38952   251.3   32.59821 1.413391          ?        ? 
1 1 1    8   20   20 o 70.09830 1.222649   69.27991   239.0   49.55890 1.714112          ?        ? 
1 1 1    8   20   21 o 8.566555 3.660534   6.696533   266.6  0.1804329 1.112669          ?        ? 
1 1 1    8   20   22 o 33.30014 1.941587   36.84529    25.4   11.57778 1.293102          ?        ? 
1 1 1    8   21    0 o 80.03310 1.353552   57.60798    -0.0   64.11382 2.165194   64.11382 2.165194 
1 1 1    8   21    1 o 289.0140 1.956156   257.1876    73.8   835.6147 11.30713          ?        ? 
1 1 1    8   21    2 f 51.43972 1.052297   113.9646   304.0   26.46349 1.082597          ?        ? 
1 1 1    8   21    3 o 75.80364 0.9719421   51.51884    44.8   57.46787 1.473535          ?        ? 
1 1 1    8   21    4 o 75.16538 1.000199   103.9835   336.7   56.50556 1.503607          ?        ? 
1 1 1    8   21    5 f 106.8607 1.083445   86.90253   190.4   114.2140 2.315555          ?        ? 
1 1 1    8   21    6 o 142.3371 1.246517   173.7028   227.3   202.6562 3.548513          ?        ? 
1 1 1    8   21    7 f 149.6508 1.296119   129.6466   186.5   224.0375 3.879307          ?        ? 
1 1 1    8   21    8 o 171.0978 1.450020   196.3715   225.3   292.9027 4.961904          ?        ? 
1 1 1    8   21    9 o 102.9796 1.168082   131.3770   228.9   106.0945 2.405771          ?        ? 
1 1 1    8   21   10 o 10.94527 3.517334   13.85053   301.0   1.172814 0.8720922          ?        ? 
1 1 1    8   21   11 o 57.43954 1.282684   51.74974   121.1   33.01921 1.473535          ?        ? 
1 1 1    8   21   12 o 9.688323 3.813551   24.87870    43.6  0.5412986 1.082597          ?        ? 
1 1 1    8   21   13 o 20.60578 2.991776   20.70652   133.7   4.270245 1.232958          ?        ? 
1 1 1    8   21   14 o 114.7132 1.350076   114.1008   272.3   131.7761 3.097431          ?        ? 
1 1 1    8   21   15 f 19.97785 3.085813   31.56235   272.7   4.029667 1.232958          ?        ? 
1 1 1    8   21   16 o 13.60136 4.029330   19.63825   324.9   1.924617 1.172814          ?        ? 
1 1 1    8   21   17 o 9.064094 3.688441   11.47402    45.1  0.3608657 1.052525          ?        ? 
1 1 1    8   21   18 o 75.75397 1.230611   82.71943    73.2   57.64830 1.864473          ?        ? 
1 1 1    8   21   19 o 14.57213 3.859167   15.95876   314.0   2.345627 1.142741          ?        ? 
1 1 1    8   21   20 o 10.24513 3.867873   10.96935   267.0  0.9322364 1.082597          ?        ? 
1 1 1    8   21   21 o 37.44154 1.646511   40.95562   354.1   14.34441 1.232958          ?        ? 
1 1 1    8   21   22 o 18.30869 3.325568   18.09471    82.8   3.879307 1.172814          ?        ? 
1 1 1    8   22    0 o 118.9466 1.593410   143.2517   180.0   141.5797 3.789090   141.5797 3.789090 
1 1 1    8   22    1 o 298.9655 2.011747   320.6139   156.0   894.2253 12.02886          ?        ? 
1 1 1    8   22    2 o 217.3985 1.708342   237.8446   102.3   472.7943 7.427820          ?        ? 
1 1 1    8   22    3 o 146.6891 1.260787   175.4394   188.2   215.2263 3.698874          ?        ? 
1 1 1    8   22    4 o 90.69845 1.044420   116.8353   295.1   82.27739 1.894545          ?        ? 
1 1 1    8   22    5 o 202.6573 1.654539   225.8160    87.6   410.9058 6.706088          ?        ? 
1 1 1    8   22    6 o 129.2408 1.175050   151.1192   110.5   167.0808 3.037287          ?        ? 
1 1 1    8   22    7 o 163.1745 1.492785   181.6330   170.5   266.4091 4.871688          ?        ? 
1 1 1    8   22    8 o 112.8239 1.239413   115.8780   219.8   127.3555 2.796710          ?        ? 
1 1 1    8   22    9 o 56.57971 1.063001   56.46579   171.4   32.02683 1.202886          ?        ? 
1 1 1    8   22   10 o 77.47713 1.028577   80.64262   358.6   60.05407 1.593824          ?        ? 
1 1 1    8   22   11 o 139.4112 1.563885   155.0760   102.4   194.5968 4.360461          ?        ? 
1 1 1    8   22   12 o 45.59142 1.451122   72.90710   234.0   20.80992 1.323174          ?        ? 
1 1 1    8   22   13 o 185.3873 1.719453   175.3197   139.2   344.3561 6.375295          ?        ? 
1 1 1    8   22   14 o 29.05649 2.225152   22.70709   320.2   8.480345 1.293102          ?        ? 
1 1 1    8   22   15 o 23.10040 2.668694   48.36559    19.6   5.382914 1.232958          ?        ? 
1 1 1    8   22   16 o 64.37151 1.378138   69.75331   217.3   41.55970 1.774257          ?        ? 
1 1 1    8   22   17 o 9.155312 3.735668   4.614995    11.8  0.3608657 1.082597          ?        ? 
1 1 1    8   22   18 o 52.30539 1.293601   59.47285   272.1   27.51601 1.353247          ?        ? 
1 1 1    8   22   19 o 37.65574 1.637145   41.83554    89.3   14.37449 1.232958          ?        ? 
1 1 1    8   22   20 o 23.57836 2.295743   19.86558    44.4   5.743780 1.082597          ?        ? 
1 1 1    8   22   21 o 19.00954 3.005706   11.47816   194.7   3.909379 1.142741          ?        ? 
1 1 1    8   22   22 o 15.85467 3.416843   17.87770   224.0   2.977142 1.052525          ?        ? 
1 1 1    8   23    0 f 13.34818 4.719299   81.78619   180.0   2.345627 1.142741   2.345627 1.142741 
1 1 1    8   23    1 o 203.2484 1.516565   198.4959   338.4   413.2514 6.164790          ?        ? 
1 1 1    8   23    2 o 126.2794 1.178792   175.2955   293.3   159.5027 2.977142          ?        ? 
1 1 1    8   23    3 o 176.8311 1.445522   200.2757   119.9   312.8104 5.112265          ?        ? 
1 1 1    8   23    4 o 265.8677 1.956793   292.9840   339.6   707.3570 10.40496          ?        ? 
1 1 1    8   23    5 o 135.0503 1.246973   153.2488    49.2   182.4477 3.368080          ?        ? 
1 1 1    8   23    6 o 231.3084 1.716118   272.7158   108.0   535.4345 7.939046          ?        ? 
1 1 1    8   23    7 o 147.5664 1.467268   122.8318   262.5   217.9028 4.330389          ?        ? 
1 1 1    8   23    8 f 92.59232 1.055535   83.45934   305.7   85.76576 1.954689          ?        ? 
1 1 1    8   23    9 o 101.8919 1.092009   114.5468   274.1   103.8692 2.225339          ?        ? 
1 1 1    8   23   10 o 105.6792 1.124014   97.26032   333.8   111.7481 2.375700          ?        ? 
1 1 1    8   23   11 o 92.00513 1.127643   108.3360    61.2   84.71323 2.074978          ?        ? 
1 1 1    8   23   12 o 98.81948 1.156393   98.16562   109.3   97.73447 2.285483          ?        ? 
1 1 1    8   23   13 o 92.79271 1.328723   85.89645    29.0   86.21684 2.465916          ?        ? 
1 1 1    8   23   14 o 73.93839 1.321837   78.16322   276.9   54.76138 1.954689          ?        ? 
1 1 1    8   23   15 o 29.44155 2.196050   28.69217   144.6   8.720922 1.293102          ?        ? 
1 1 1    8   23   16 o 44.06276 1.569714   44.95219   111.5   19.51682 1.383319          ?        ? 
1 1 1    8   23   17 o 28.78922 2.089125   34.46199   346.2   8.390128 1.202886          ?        ? 
1 1 1    8   23   18 o 31.34788 1.870643   37.26498   330.7   9.953879 1.172814          ?        ? 
1 1 1    8   23   19 o 32.79112 1.834164   32.87619   326.6   10.94626 1.202886          ?        ? 
1 1 1    8   23   20 o 9.956077 3.918335   2.698308   298.3  0.7818757 1.142741          ?        ? 
1 1 1    8   23   21 o 7.209972 3.371411   3.384396   117.6 -0.8119479 1.202886          ?        ? 
1 1 1    8   24    0 f 7.216532 4.315616   58.36258    -0.0  0.5713707 1.082597  0.5713707 1.082597 
1 1 1    8   24    1 o 163.4787 1.342845   128.4872   178.7   267.3414 4.390533          ?        ? 
1 1 1    8   24    2 o 152.6180 1.330033   137.9263   323.5   232.9990 4.059740          ?        ? 
1 1 1    8   24    3 o 97.97905 1.058889   115.2743   331.5   96.02036 2.074978          ?        ? 
1 1 1    8   24    4 o 34.93336 1.420391   56.96201   132.9   12.20929 0.9923807          ?        ? 
1 1 1    8   24    5 o 311.6241 2.393234   373.9445    93.0   972.5031 14.91578          ?        ? 
1 1 1    8   24    6 o 90.39387 1.014671   105.7690    85.2   81.73608 1.834401          ?        ? 
1 1 1    8   24    7 o 56.71510 1.033952   29.78367   159.2   32.17720 1.172814          ?        ? 
1 1 1    8   24    8 o 54.13416 1.111023   45.46942   145.1   29.32034 1.202886          ?        ? 
1 1 1    8   24    9 o 52.95444 1.078986   59.13785   191.0   28.05731 1.142741          ?        ? 
1 1 1    8   24   10 o 25.86807 1.976284   27.98779   172.3   6.706088 1.022453          ?        ? 
1 1 1    8   24   11 o 59.59255 1.286805   59.87871    59.0   35.54527 1.533679          ?        ? 
1 1 1    8   24   12 o 89.01077 1.165577   109.5613   276.5   79.30025 2.074978          ?        ? 
1 1 1    8   24   13 o 103.3012 1.208112   109.4739    27.3   106.8463 2.495988          ?        ? 
1 1 1    8   24   14 f 63.35228 1.234172   71.83402   175.7   40.20646 1.563751          ?        ? 
1 1 1    8   24   15 o 69.64895 1.252125   71.25649   114.9   48.62666 1.744184          ?        ? 
1 1 1    8   24   16 o 49.57010 1.455982   53.60497   231.8   24.68923 1.443463          ?        ? 
1 1 1    8   24   17 o 38.63582 1.751285   42.06370    42.7   15.06614 1.353247          ?        ? 
1 1 1    8   24   18 o 17.56882 2.738683   22.23556   118.0   3.187647 0.9623086          ?        ? 
1 1 1    8   24   19 f 25.65261 2.285954   30.36700    10.2   6.796305 1.172814          ?        ? 
1 1 1    8   24   20 o 10.97391 4.002831   5.565839    74.7   1.232958 1.142741          ?        ? 
1 1 1    8   24   21 o 22.09911 2.653532   21.14551   327.8   5.292697 1.172814          ?        ? 
1 1 1    8   25    0 f 240.0194 2.531500   287.7535    -0.0   576.6935 12.14915   576.6935 12.14915 
1 1 1    8   25    1 o 190.4742 1.420924   172.6063   280.5   362.9708 5.412986          ?        ? 
1 1 1    8   25    2 o 7.049944 3.010596   42.68089   327.0      -0.03 0.7518036          ?        ? 
1 1 1    8   25    3 o 69.57262 1.015767   73.43749   130.7   48.41615 1.413391          ?        ? 
1 1 1    8   25    4 o 185.6497 1.636031   195.8178    43.6   344.8974 6.074574          ?        ? 
1 1 1    8   25    5 o 115.2153 1.122336   147.5041   106.6   132.7986 2.586205          ?        ? 
1 1 1    8   25    6 f 183.5358 1.433678   246.3256   182.6   337.0787 5.262625          ?        ? 
1 1 1    8   25    7 o 75.64993 1.073296   84.97772   248.3   57.25736 1.623896          ?        ? 
1 1 1    8   25    8 o 159.4242 1.301545   152.3383   182.9   254.3502 4.149956          ?        ? 
1 1 1    8   25    9 o 152.7255 1.427548   161.8418     3.6   233.4801 4.360461          ?        ? 
1 1 1    8   25   10 o 40.49800 1.410861   29.34504   337.2   16.41939 1.142741          ?        ? 
1 1 1    8   25   11 o 94.80318 1.094361   90.50771   134.8   89.94579 2.074978          ?        ? 
1 1 1    8   25   12 o 36.74631 1.718581   51.37733   259.8   13.53246 1.263030          ?        ? 
1 1 1    8   25   13 o 32.98133 1.914765   25.35528   207.2   10.91619 1.263030          ?        ? 
1 1 1    8   25   14 o 73.01160 1.256239   91.67847   182.6   53.40813 1.834401          ?        ? 
1 1 1    8   25   15 o 56.87541 1.295406   51.13219   358.1   32.44785 1.473535          ?        ? 
1 1 1    8   25   16 o 39.80549 1.510954   29.21073   254.9   15.93824 1.202886          ?        ? 
1 1 1    8   25   17 f 42.56998 1.730721   44.07184    13.8   18.31394 1.473535          ?        ? 
1 1 1    8   25   18 o 35.85606 1.845120   39.83265   238.1   13.08138 1.323174          ?        ? 
1 1 1    8   25   19 o 11.84903 3.976717   6.210773   119.5   1.503607 1.112669          ?        ? 
1 1 1    8   25   20 o 11.53093 3.974316   11.06654     8.8   1.473535 1.112669          ?        ? 
1 1 1    8   25   21 o 18.67300 2.979353   23.01993   338.9   3.879307 1.112669          ?        ? 
1 1 1    8   26    0 o 64.36808 1.379622   76.95432   180.0   41.49956 1.774257   41.49956 1.774257 
1 1 1    8   26    1 o 113.4340 1.047172   129.6824   121.2   128.7088 2.375700          ?        ? 
1 1 1    8   26    2 o 51.78511 1.016243   72.18958    65.0   26.82435 1.052525          ?        ? 
1 1 1    8   26    3 o 80.01875 1.108650   90.33246    48.4   64.05367 1.774257          ?        ? 
1 1 1    8   26    4 o 152.2466 1.293773   146.8419    39.3   231.9164 3.939451          ?        ? 
1 1 1    8   26    5 o 167.0028 1.341519   150.6093   298.4   279.0695 4.480750          ?        ? 
1 1 1    8   26    6 o 44.02728 1.229462   51.74783   166.9   19.39653 1.082597          ?        ? 
1 1 1    8   26    7 o 178.3994 1.466528   161.2165   188.9   318.5542 5.232553          ?        ? 
1 1 1    8   26    8 o 25.28735 1.902747   32.16333    89.5   6.405366 0.9623086          ?        ? 
1 1 1    8   26    9 o 90.37550 1.098064   93.52365   170.1   81.73608 1.984761          ?        ? 
1 1 1    8   26   10 o 68.68896 1.072614   62.28922    35.4   47.21327 1.473535          ?        ? 
1 1 1    8   26   11 o 68.17789 1.124763   70.47874   257.3   46.52161 1.533679          ?        ? 
1 1 1    8   26   12 o 77.13036 1.247639   85.75319   311.7   59.57292 1.924617          ?        ? 
1 1 1    8   26   13 o 23.37401 2.508799   23.93177   114.7   5.503202 1.172814          ?        ? 
1 1 1    8   26   14 o 29.58495 2.083759   39.66818   138.4   8.811138 1.232958          ?        ? 
1 1 1    8   26   15 o 77.07745 1.111941   77.36420   311.4   59.57292 1.714112          ?        ? 
1 1 1    8   26   16 o 43.91004 1.438202   39.07262   332.3   19.39653 1.263030          ?        ? 
1 1 1    8   26   17 o 33.29056 1.580816   33.61263   299.1   11.18684 1.052525          ?        ? 
1 1 1    8   26   18 o 29.73618 1.921467   34.69683    31.3   9.021644 1.142741          ?        ? 
1 1 1    8   26   19 o 23.72653 2.281406   16.64717    38.5   5.833996 1.082597          ?        ? 
1 1 1    8   26   20 o 15.21682 3.607496   20.16030   236.6   2.706493 1.082597          ?        ? 
1 1 1    8   27    0 f 21.55813 2.720694   8.296685   180.0   4.871688 1.142741   4.871688 1.142741 
1 1 1    8   27    1 o 73.04916 0.9674243   83.88377   159.7   53.37806 1.413391          ?        ? 
1 1 1    8   27    2 o 194.3960 1.539218   197.5692   164.6   378.1873 5.984357          ?        ? 
1 1 1    8   27    3 o 128.2773 1.324534   142.7748   199.1   164.6450 3.398152          ?        ? 
1 1 1    8   27    4 o 135.2811 1.178157   177.4373   207.6   183.1093 3.187647          ?        ? 
1 1 1    8   27    5 o 55.74910 1.078839   56.26123   148.5   31.09460 1.202886          ?        ? 
1 1 1    8   27    6 o 177.2163 1.450864   180.8943   134.5   314.3441 5.142337          ?        ? 
1 1 1    8   27    7 o 71.48000 1.093838   46.58107   104.3   51.12265 1.563751          ?        ? 
1 1 1    8   27    8 o 105.8171 1.065711   105.0647    31.7   112.0488 2.255411          ?        ? 
1 1 1    8   27    9 o 52.37722 1.205705   49.68515   262.7   27.45587 1.263030          ?        ? 
1 1 1    8   27   10 o 70.98954 1.037854   76.03104   198.6   50.43098 1.473535          ?        ? 
1 1 1    8   27   11 o 66.50211 1.085276   75.55798   147.6   44.26620 1.443463          ?        ? 
1 1 1    8   27   12 o 81.82866 1.249505   75.17788    55.3   67.06088 2.044906          ?        ? 
1 1 1    8   27   13 o 58.61389 1.359596   61.97245    61.1   34.43261 1.593824          ?        ? 
1 1 1    8   27   14 o 42.70065 1.584574   49.05220   110.8   18.31394 1.353247          ?        ? 
1 1 1    8   27   15 o 75.57179 1.213681   90.75767   175.5   57.31751 1.834401          ?        ? 
1 1 1    8   27   16 o 30.25578 1.888468   41.58953   297.9   9.262220 1.142741          ?        ? 
1 1 1    8   27   17 o 22.94152 2.425012   17.51774   290.1   5.412986 1.112669          ?        ? 
1 1 1    8   27   18 o 62.18173 1.281585   60.34015    15.3   39.06371 1.593824          ?        ? 
1 1 1    8   27   19 o 6.821060 3.192549   4.233082   185.4 -0.8420200 1.082597          ?        ? 
1 1 1    8   27   20 o 12.84513 3.949195   11.85237   270.8   2.014834 1.112669          ?        ? 
1 1 1    8   28    0 o 8.667307 4.677001   44.56501   180.0   1.082597 1.112669   1.082597 1.112669 
1 1 1    8   28    1 o 33.30128 1.264246   21.21934   194.9   11.09662 0.8420200          ?        ? 
1 1 1    8   28    2 o 133.4814 1.126454   135.9028    96.9   178.2677 3.007215          ?        ? 
1 1 1    8   28    3 o 45.14041 1.199144   75.07995   196.4   20.38891 1.082597          ?        ? 
1 1 1    8   28    4 f 78.01978 1.021423   55.24725   283.3   60.89609 1.593824          ?        ? 
1 1 1    8   28    5 o 73.86088 1.017864   85.99258    54.9   54.58094 1.503607          ?        ? 
1 1 1    8   28    6 o 97.54890 1.063558   100.3322   313.0   95.20841 2.074978          ?        ? 
1 1 1    8   28    7 o 95.95367 1.128250   82.29918   332.4   92.14105 2.165194          ?        ? 
1 1 1    8   28    8 o 95.20411 1.089752   86.59893   190.1   90.69759 2.074978          ?        ? 
1 1 1    8   28    9 o 118.2984 1.194767   139.2004    74.4   140.0760 2.826782          ?        ? 
1 1 1    8   28   10 o 82.36745 1.095292   76.83228    64.8   67.90290 1.804329          ?        ? 
1 1 1    8   28   11 o 57.47535 1.203402   54.10932   357.4   33.07936 1.383319          ?        ? 
1 1 1    8   28   12 o 111.5926 1.333934   103.5719   143.3   124.7994 2.977142          ?        ? 
1 1 1    8   28   13 o 92.36322 1.188388   71.68800    23.7   85.49510 2.195267          ?        ? 
1 1 1    8   28   14 o 48.23755 1.371519   51.11469   123.0   23.36606 1.323174          ?        ? 
1 1 1    8   28   15 o 20.07745 2.770943   30.55081   190.3   4.119884 1.112669          ?        ? 
1 1 1    8   28   16 o 9.147365 3.798236   13.39849   321.9  0.3007214 1.142741          ?        ? 
1 1 1    8   28   17 o 34.80210 1.857794   35.41835   299.3   12.32958 1.293102          ?        ? 
1 1 1    8   28   18 o 50.03068 1.472631   39.67256   171.9   25.38089 1.473535          ?        ? 
1 1 1    8   28   19 o 36.07863 1.833737   29.53156   204.4   13.41218 1.323174          ?        ? 
1 1 1    8   28   20 o 34.39471 1.704933   24.83787   220.8   12.26943 1.172814          ?        ? 
1 1 1    8   29    0 o 53.85827 1.426024   30.61552     0.0   29.07976 1.533679   29.07976 1.533679 
1 1 1    8   29    1 o 73.78400 0.9577894   73.62937    53.8   54.46066 1.413391          ?        ? 
1 1 1    8   29    2 f 82.71198 1.054372   78.28338   289.3   68.44421 1.744184          ?        ? 
1 1 1    8   29    3 o 65.60574 1.054266   100.8419   212.2   43.06331 1.383319          ?        ? 
1 1 1    8   29    4 o 22.11483 2.175709   41.77382   218.4   4.901759 0.9623086          ?        ? 
1 1 1    8   29    5 o 91.70232 1.082176   65.93499    47.1   84.14186 1.984761          ?        ? 
1 1 1    8   29    6 o 56.83628 1.111112   65.24746   348.5   32.32756 1.263030          ?        ? 
1 1 1    8   29    7 o 185.5387 1.523553   184.4478    55.0   344.6869 5.653563          ?        ? 
1 1 1    8   29    8 o 55.13931 1.227116   73.71839   277.5   30.43301 1.353247          ?        ? 
1 1 1    8   29    9 o 112.7861 1.159840   107.5965    23.1   127.3255 2.616277          ?        ? 
1 1 1    8   29   10 o 66.10354 1.228297   59.23734   201.7   43.75497 1.623896          ?        ? 
1 1 1    8   29   11 o 65.50468 1.193618   58.50539   348.9   42.97309 1.563751          ?        ? 
1 1 1    8   29   12 o 28.67010 2.150251   25.15644   321.4   8.269840 1.232958          ?        ? 
1 1 1    8   29   13 o 36.83609 1.796030   39.83653   250.5   13.65275 1.323174          ?        ? 
1 1 1    8   29   14 o 40.87374 1.581825   45.49233   106.3   16.81033 1.293102          ?        ? 
1 1 1    8   29   15 o 26.60998 2.147205   28.64279   186.4   7.187243 1.142741          ?        ? 
1 1 1    8   29   16 o 50.81666 1.361088   53.31083    32.2   26.04248 1.383319          ?        ? 
1 1 1    8   29   17 o 26.88479 2.404896   25.51816    42.1   7.487964 1.293102          ?        ? 
1 1 1    8   29   18 o 20.75929 2.824792   16.86484   299.9   4.570966 1.172814          ?        ? 
1 1 1    8   29   19 o 21.15469 2.843071   20.45243   153.4   4.871688 1.202886          ?        ? 
1 1 1    8   30    0 o 177.7904 1.979533   175.1234    -0.0   316.5093 7.036882   316.5093 7.036882 
1 1 1    8   30    1 o 35.43979 1.315240   21.28398   202.1   12.57016 0.9322364          ?        ? 
1 1 1    8   30    2 o 157.4334 1.251148   157.1472   226.7   248.0350 3.939451          ?        ? 
1 1 1    8   30    3 o 21.83892 2.272046   8.987330    32.2   4.781471 0.9923807          ?        ? 
1 1 1    8   30    4 o 80.99775 1.039560   61.48144   300.6   65.64749 1.684040          ?        ? 
1 1 1    8   30    5 o 12.16436 3.659317   23.48365    61.6   1.503607 0.9623086          ?        ? 
1 1 1    8   30    6 o 38.94887 1.389767   63.47539   134.7   15.18643 1.082597          ?        ? 
1 1 1    8   30    7 o 13.36243 3.914306   12.99881   203.2   1.834401 1.112669          ?        ? 
1 1 1    8   30    8 o 76.95115 1.191926   81.53753   287.1   59.27220 1.834401          ?        ? 
1 1 1    8   30    9 o 105.1225 1.172878   85.77176   293.0   110.6354 2.465916          ?        ? 
1 1 1    8   30   10 o 20.44460 2.721182   16.79453   213.3   4.210100 1.112669          ?        ? 
1 1 1    8   30   11 o 43.85282 1.405791   29.55679   337.4   19.27625 1.232958          ?        ? 
1 1 1    8   30   12 o 51.47861 1.431211   65.70207   104.8   26.58378 1.473535          ?        ? 
1 1 1    8   30   13 o 31.80145 1.891244   31.10251   217.0   10.19446 1.202886          ?        ? 
1 1 1    8   30   14 o 8.558385 3.709494   12.31598   121.9      -0.09 1.172814          ?        ? 
1 1 1    8   30   15 o 89.89066 1.271257   81.91150   269.1   81.28500 2.285483          ?        ? 
1 1 1    8   30   16 o 47.37259 1.587001   46.42656   226.9   22.73454 1.503607          ?        ? 
1 1 1    8   30   17 o 15.80824 4.067254   26.01264   138.2   2.856854 1.293102          ?        ? 
1 1 1    8   30   18 o 18.20270 3.512082   9.597234   166.6   3.759018 1.232958          ?        ? 
1 1 1    8   30   19 o 7.978437 3.590405   16.37542   206.4 -0.1804329 1.202886          ?        ? 
1 1 1    8   31    0 o 59.57246 1.465888   96.17946   180.0   35.57535 1.744184   35.57535 1.744184 
1 1 1    8   31    1 o 63.95492 1.034459   72.14682   118.0   40.92819 1.323174          ?        ? 
1 1 1    8   31    2 o 67.74323 1.021001   81.03677   178.5   45.92016 1.383319          ?        ? 
1 1 1    8   31    3 o 110.3839 1.171460   88.53564   359.5   121.9426 2.586205          ?        ? 
1 1 1    8   31    4 o 39.06108 1.501256   66.70677   184.3   15.27665 1.172814          ?        ? 
1 1 1    8   31    5 o 115.0531 1.110849   105.1678   122.0   132.4678 2.556132          ?        ? 
1 1 1    8   31    6 o 95.08520 1.122742   97.86535    84.0   90.48708 2.135122          ?        ? 
1 1 1    8   31    7 o 126.7887 1.209635   136.2359    94.1   160.9160 3.067359          ?        ? 
1 1 1    8   31    8 o 9.742079 3.819648   17.56472   120.9  0.5713707 1.082597          ?        ? 
1 1 1    8   31    9 o 34.58614 1.782445   23.19214   311.2   11.99879 1.232958          ?        ? 
1 1 1    8   31   10 o 64.80659 1.183274   72.81956   267.6   42.07093 1.533679          ?        ? 
1 1 1    8   31   11 o 34.99116 1.718843   45.89613   247.9   12.29951 1.202886          ?        ? 
1 1 1    8   31   12 o 40.06057 1.689000   50.38432   205.1   16.14874 1.353247          ?        ? 
1 1 1    8   31   13 o 66.34019 1.291911   63.96790   153.4   44.20605 1.714112          ?        ? 
1 1 1    8   31   14 o 59.24128 1.421340   56.19871   206.3   35.33477 1.684040          ?        ? 
1 1 1    8   31   15 f 42.23847 1.673108   48.20313   116.4   18.07336 1.413391          ?        ? 
1 1 1    8   31   16 o 14.34191 4.286207   22.54706   232.3   2.345627 1.323174          ?        ? 
1 1 1    8   31   17 o 8.786960 3.829482   6.192453   335.1       0.03 1.263030          ?        ? 
1 1 1    8   31   18 o 7.597981 3.498501   6.415892   293.6 -0.6014429 1.232958          ?        ? 
1 1 1    8   32    0 o 196.8436 2.353440   230.5994   180.0   388.2314 9.262220   388.2314 9.262220 
1 1 1    8   32    1 o 76.18193 1.006590   71.81293   123.0   58.06931 1.533679          ?        ? 
1 1 1    8   32    2 o 80.57231 1.007726   102.7130    69.4   64.95583 1.623896          ?        ? 
1 1 1    8   32    3 o 67.32140 1.005064   68.46819    79.2   45.34880 1.353247          ?        ? 
1 1 1    8   32    4 o 29.85365 1.813174   23.20970    46.5   8.931427 1.082597          ?        ? 
1 1 1    8   32    5 o 65.18142 1.130334   56.66557    13.3   42.52201 1.473535          ?        ? 
1 1 1    8   32    6 o 14.57122 3.784769   20.03261   283.8   2.225339 1.112669          ?        ? 
1 1 1    8   32    7 o 71.04015 1.121777   67.57048   207.1   50.52120 1.593824          ?        ? 
1 1 1    8   32    8 o 15.76131 3.687029   48.94791   132.0   2.616277 1.142741          ?        ? 
1 1 1    8   32    9 o 81.67429 1.178227   79.90994   259.8   66.82030 1.924617          ?        ? 
1 1 1    8   32   10 o 15.91245 3.496651   25.25096    48.9   2.676421 1.082597          ?        ? 
1 1 1    8   32   11 o 51.27190 1.290350   59.45670   293.2   26.37327 1.323174          ?        ? 
1 1 1    8   32   12 o 23.13655 2.664524   18.79361    81.7   5.443058 1.232958          ?        ? 
1 1 1    8   32   13 f 16.39537 3.902704   3.130050    99.2   2.916998 1.263030          ?        ? 
1 1 1    8   32   14 o 42.20397 1.603222   39.67102   332.0   17.98314 1.353247          ?        ? 
1 1 1    8   32   15 o 16.49081 3.888243   17.87312     0.9   3.037287 1.263030          ?        ? 
1 1 1    8   32   16 o 32.19096 2.195323   24.53174   225.9   10.67561 1.413391          ?        ? 
1 1 1    8   32   17 f 24.11306 2.743688   22.98693   192.3   6.194862 1.323174          ?        ? 
1 1 1    8   32   18 o 11.72004 4.169296   11.03042    67.6   1.623896 1.232958          ?        ? 
1 1 1    8   33    0 o 77.39126 1.419357   25.45740   360.0   59.99393 2.195267   59.99393 2.195267 
1 1 1    8   33    1 o 46.21669 1.236287   19.58692   330.3   21.38129 1.142741          ?        ? 
1 1 1    8   33    2 f 76.68401 1.098039   89.68869     2.0   58.85118 1.684040          ?        ? 
1 1 1    8   33    3 o 27.00044 1.893401   15.04256    32.4   7.307531 1.022453          ?        ? 
1 1 1    8   33    4 o 81.70895 1.104120   88.36845    14.2   66.82030 1.804329          ?        ? 
1 1 1    8   33    5 o 68.36726 1.187627   52.24816   236.5   46.79226 1.623896          ?        ? 
1 1 1    8   33    6 f 107.7844 1.171811   62.85037   151.3   116.3191 2.526060          ?        ? 
1 1 1    8   33    7 o 26.06642 2.191980   26.69018   228.2   6.826377 1.142741          ?        ? 
1 1 1    8   33    8 o 8.598768 3.666976   14.26794   259.3   0.000000 1.112669          ?        ? 
1 1 1    8   33    9 o 23.36528 2.381031   15.95022    40.4   5.503202 1.112669          ?        ? 
1 1 1    8   33   10 o 57.22304 1.287537   48.09525    97.3   32.83878 1.473535          ?        ? 
1 1 1    8   33   11 o 59.16620 1.219838   61.89981    72.1   35.12427 1.443463          ?        ? 
1 1 1    8   33   12 o 44.18583 1.599371   52.93969   318.3   19.66718 1.413391          ?        ? 
1 1 1    8   33   13 o 46.98100 1.504215   41.61860   105.8   22.25339 1.413391          ?        ? 
1 1 1    8   33   14 o 11.16383 4.186017   10.72737   280.5   1.112669 1.263030          ?        ? 
1 1 1    8   33   15 o 39.45568 1.867329   33.80425    12.6   15.90816 1.473535          ?        ? 
1 1 1    8   33   16 o 16.50085 3.886722   14.86109    97.4   3.127503 1.263030          ?        ? 
1 1 1    8   33   17 o 10.16742 4.136187   8.613383   117.7  0.8119479 1.323174          ?        ? 
1 1 1    8   33   18 o 25.53341 2.591065   23.59824   217.3   7.097026 1.323174          ?        ? 
1 1 1    8   34    0 o 41.43318 1.858827   20.64528   180.0   17.29148 1.533679   17.29148 1.533679 
1 1 1    8   34    1 o 88.81140 1.066612   92.04338   242.6   78.93938 1.894545          ?        ? 
1 1 1    8   34    2 o 41.98403 1.396738   47.23038   339.4   17.65235 1.172814          ?        ? 
1 1 1    8   34    3 o 45.32318 1.293834   48.97157    26.4   20.56935 1.172814          ?        ? 
1 1 1    8   34    4 o 60.90276 1.209744   53.31839   141.9   37.13910 1.473535          ?        ? 
1 1 1    8   34    5 o 53.04119 1.275656   46.73700    31.8   28.17760 1.353247          ?        ? 
1 1 1    8   34    6 o 82.50793 1.184546   78.27198   246.7   68.17355 1.954689          ?        ? 
1 1 1    8   34    7 o 8.061446 3.552557   7.722186   224.4 -0.3007214 1.112669          ?        ? 
1 1 1    8   34    8 o 20.45806 3.013380   12.29758   148.0   4.240172 1.232958          ?        ? 
1 1 1    8   34    9 o 55.22008 1.334239   64.29123    67.1   30.58337 1.473535          ?        ? 
1 1 1    8   34   10 o 13.34192 4.045056   22.61310    31.3   1.864473 1.172814          ?        ? 
1 1 1    8   34   11 o 32.47285 1.852141   35.02872   236.9   10.64554 1.202886          ?        ? 
1 1 1    8   34   12 o 53.99866 1.503644   60.30908     9.5   29.38048 1.623896          ?        ? 
1 1 1    8   34   13 f 29.67363 2.229546   19.69573    37.0   8.991571 1.323174          ?        ? 
1 1 1    8   34   14 o 12.65001 4.236901   11.12463   212.1   1.714112 1.263030          ?        ? 
1 1 1    8   34   15 o 23.92297 2.954046   17.32637    81.1   6.044501 1.413391          ?        ? 
1 1 1    8   34   16 o 9.231588 3.945494   8.001095   226.6  0.3007214 1.293102          ?        ? 
1 1 1    8   34   17 o 8.772584 3.885127   7.478440   225.2       0.06 1.353247          ?        ? 
1 1 1    8   35    0 o 50.64395 1.726402   52.70293     0.0   25.77183 1.744184   25.77183 1.744184 
1 1 1    8   35    1 o 129.7619 1.147156   121.3282   292.3   168.5844 2.977142          ?        ? 
1 1 1    8   35    2 o 108.3306 1.110384   89.97346   303.4   117.4919 2.405771          ?        ? 
1 1 1    8   35    3 o 26.58716 2.035940   19.66111   299.8   7.097026 1.082597          ?        ? 
1 1 1    8   35    4 o 62.14202 1.209815   45.89357   123.4   38.67278 1.503607          ?        ? 
1 1 1    8   35    5 o 94.17719 1.149532   91.41319    52.2   88.83311 2.165194          ?        ? 
1 1 1    8   35    6 o 17.63332 3.277590   27.31055   155.3   3.247792 1.112669          ?        ? 
1 1 1    8   35    7 o 26.42803 2.218883   44.14457    23.7   7.036882 1.172814          ?        ? 
1 1 1    8   35    8 o 50.77653 1.332551   41.20978   165.5   25.86205 1.353247          ?        ? 
1 1 1    8   35    9 o 56.61361 1.327956   51.15689     8.3   32.17720 1.503607          ?        ? 
1 1 1    8   35   10 f 34.41754 1.703802   29.37202    36.9   11.93864 1.172814          ?        ? 
1 1 1    8   35   11 o 43.58123 1.483554   34.95384    17.6   19.12588 1.293102          ?        ? 
1 1 1    8   35   12 o 55.66507 1.485643   55.43785    55.1   31.24496 1.653968          ?        ? 
1 1 1    8   35   13 o 35.66723 2.023514   34.55811    82.9   12.99117 1.443463          ?        ? 
1 1 1    8   35   14 o 36.28019 1.947882   29.04664    46.6   13.47232 1.413391          ?        ? 
1 1 1    8   35   15 o 12.97391 4.336606   8.978849   260.8   1.924617 1.323174          ?        ? 
1 1 1    8   35   16 o 11.98386 4.269110   10.90751   177.7   1.653968 1.293102          ?        ? 
1 1 1    8   36    0 o 29.81161 2.557938   23.32492   360.0   9.111859 1.503607   9.111859 1.503607 
1 1 1    8   36    1 f 60.43425 1.069842   29.73618   135.7   36.56773 1.293102          ?        ? 
1 1 1    8   36    2 o 40.02398 1.465139   38.67362   357.3   16.05853 1.172814          ?        ? 
1 1 1    8   36    3 o 109.2593 1.142231   107.2962    47.6   119.5668 2.495988          ?        ? 
1 1 1    8   36    4 o 25.33766 2.433053   30.09148    42.3   6.465511 1.232958          ?        ? 
1 1 1    8   36    5 o 125.0397 1.286679   105.8118   151.1   156.7059 3.217719          ?        ? 
1 1 1    8   36    6 o 53.54982 1.291618   36.45073   100.4   28.74897 1.383319          ?        ? 
1 1 1    8   36    7 o 23.70610 2.410227   28.53453    58.2   5.683635 1.142741          ?        ? 
1 1 1    8   36    8 o 60.17499 1.199388   54.89678   186.4   36.32715 1.443463          ?        ? 
1 1 1    8   36    9 o 10.44352 4.040214   17.03588   306.9  0.7818757 1.202886          ?        ? 
1 1 1    8   36   10 o 37.63082 1.678186   33.15607   305.3   14.28427 1.263030          ?        ? 
1 1 1    8   36   11 o 25.40092 2.367799   31.03183    52.2   6.585800 1.202886          ?        ? 
1 1 1    8   36   12 o 14.52421 3.790468   6.208358   293.5   2.345627 1.112669          ?        ? 
1 1 1    8   36   13 o 28.47995 2.586970   26.79566   107.8   8.450273 1.473535          ?        ? 
1 1 1    8   36   14 o 15.35337 4.192325   15.89228   258.7   2.736565 1.323174          ?        ? 
1 1 1    8   36   15 o 29.73463 2.376675   29.36979   168.0   9.292293 1.413391          ?        ? 
1 1 1    8   36   16 o 9.649399 4.101046   10.95524   290.7  0.5713707 1.383319          ?        ? 
1 1 1    8   37    0 o 9.205873 5.263235   16.88517   180.0   1.142741 1.503607   1.142741 1.503607 
1 1 1    8   37    1 o 46.15395 1.368279   27.74478   247.0   21.35122 1.263030          ?        ? 
1 1 1    8   37    2 o 36.73090 1.514623   31.58084   343.8   13.53246 1.112669          ?        ? 
1 1 1    8   37    3 o 93.31198 1.031281   83.75943    99.3   87.20922 1.924617          ?        ? 
1 1 1    8   37    4 o 86.24618 1.202939   68.03981    85.4   74.54884 2.074978          ?        ? 
1 1 1    8   37    5 o 8.739745 3.721309   14.46326   302.9       0.03 1.142741          ?        ? 
1 1 1    8   37    6 o 60.66680 1.239234   47.23046   288.2   36.92860 1.503607          ?        ? 
1 1 1    8   37    7 o 19.88655 2.873151   20.46188    94.7   4.029667 1.142741          ?        ? 
1 1 1    8   37    8 o 23.32984 2.449099   28.61150   121.5   5.533275 1.142741          ?        ? 
1 1 1    8   37    9 o 9.942840 3.984104   15.14729   243.9  0.5713707 1.202886          ?        ? 
1 1 1    8   37   10 o 19.21571 3.051706   11.47388   226.6   3.819162 1.172814          ?        ? 
1 1 1    8   37   11 o 39.99035 1.654367   43.38850   222.2   16.20889 1.323174          ?        ? 
1 1 1    8   37   12 o 23.71263 2.536382   18.46874   126.9   5.833996 1.202886          ?        ? 
1 1 1    8   37   13 o 10.79380 4.258928   7.268799   151.4  0.9322364 1.353247          ?        ? 
1 1 1    8   37   14 o 12.10308 4.405112   13.44850     1.6   1.593824 1.383319          ?        ? 
1 1 1    8   37   15 o 22.93127 3.081798   20.00710   136.0   5.833996 1.413391          ?        ? 
1 1 1    8   38    0 o 46.22932 1.860457   32.65938     0.0   21.53165 1.714112   21.53165 1.714112 
1 1 1    8   38    1 o 27.99263 1.880004   23.58579   327.0   7.878902 1.052525          ?        ? 
1 1 1    8   38    2 o 37.88243 1.508273   39.28037   167.1   14.40456 1.142741          ?        ? 
1 1 1    8   38    3 o 27.69928 1.954197   18.79635   291.4   7.728541 1.082597          ?        ? 
1 1 1    8   38    4 o 29.75254 2.021484   33.77562    38.9   8.931427 1.202886          ?        ? 
1 1 1    8   38    5 f 28.20631 2.025685   7.498380    92.7   8.029263 1.142741          ?        ? 
1 1 1    8   38    6 o 29.43006 2.043634   36.41569   300.0   8.750995 1.202886          ?        ? 
1 1 1    8   38    7 o 13.36823 4.043463   7.100834    69.1   1.894545 1.172814          ?        ? 
1 1 1    8   38    8 o 28.73165 1.988646   27.25736   140.0   8.360056 1.142741          ?        ? 
1 1 1    8   38    9 o 36.45265 1.773674   37.59037   241.7   13.44225 1.293102          ?        ? 
1 1 1    8   38   10 o 17.94326 3.562303   26.16888   167.2   3.518441 1.232958          ?        ? 
1 1 1    8   38   11 o 31.46784 2.054641   27.95177   198.3   10.13431 1.293102          ?        ? 
1 1 1    8   38   12 o 8.360803 3.643172   6.598713   170.4      -0.03 1.142741          ?        ? 
1 1 1    8   38   13 f 29.52327 2.699267   28.23251   135.7   9.232149 1.593824          ?        ? 
1 1 1    8   38   14 o 25.50040 2.771311   26.32991   156.4   7.006810 1.413391          ?        ? 
1 1 1    8   38   15 o 8.669170 3.857270   3.779975   339.8       0.03 1.353247          ?        ? 
1 1 1    8   39    0 o 45.65675 1.817557   37.75537   180.0   21.02043 1.653968   21.02043 1.653968 
1 1 1    8   39    1 o 20.65217 2.621025   18.34845    98.2   4.330389 1.082597          ?        ? 
1 1 1    8   39    2 o 51.90488 1.245646   41.82175   213.3   27.03486 1.293102          ?        ? 
1 1 1    8   39    3 o 19.68690 2.673161   18.96927   323.5   3.939451 1.052525          ?        ? 
1 1 1    8   39    4 o 54.80179 1.316985   49.95089    25.3   30.16236 1.443463          ?        ? 
1 1 1    8   39    5 o 41.25346 1.603713   37.97672   181.4   17.14112 1.323174          ?        ? 
1 1 1    8   39    6 o 45.36238 1.524742   37.75845   237.8   20.71971 1.383319          ?        ? 
1 1 1    8   39    7 o 23.71778 2.472435   20.55147   345.1   5.743780 1.172814          ?        ? 
1 1 1    8   39    8 o 12.70704 4.287049   14.07409   316.1   1.653968 1.293102          ?        ? 
1 1 1    8   39    9 o 45.81853 1.509562   47.71220   180.0   21.23093 1.383319          ?        ? 
1 1 1    8   39   10 o 11.27778 4.153507   13.61847   165.5   1.202886 1.232958          ?        ? 
1 1 1    8   39   11 o 46.48989 1.520106   45.26836     8.8   21.92259 1.413391          ?        ? 
1 1 1    8   39   12 o 13.15231 4.233547   13.37817   278.7   1.984761 1.263030          ?        ? 
1 1 1    8   39   13 o 11.57642 4.405045   9.441564     8.7   1.383319 1.413391          ?        ? 
1 1 1    8   39   14 o 7.624360 3.625867   9.018209   182.2  -1.232958 1.503607          ?        ? 
1 1 1    8   40    0 o 27.39517 2.681599   34.33271     0.0   7.788685 1.443463   7.788685 1.443463 
1 1 1    8   40    1 o 45.07284 1.367739   46.40853   297.8   20.41899 1.232958          ?        ? 
1 1 1    8   40    2 o 43.27683 1.355013   50.48804    40.6   18.82516 1.172814          ?        ? 
1 1 1    8   40    3 o 31.03067 1.744399   16.87271   131.1   9.713303 1.082597          ?        ? 
1 1 1    8   40    4 o 18.18988 3.349323   20.45835   247.2   3.518441 1.172814          ?        ? 
1 1 1    8   40    5 o 37.40165 1.768872   26.64686   230.8   14.13391 1.323174          ?        ? 
1 1 1    8   40    6 o 26.43427 2.332121   17.96276    90.9   7.127099 1.232958          ?        ? 
1 1 1    8   40    7 o 52.78901 1.395684   37.40430    26.8   28.08738 1.473535          ?        ? 
1 1 1    8   40    8 o 32.82156 1.924086   24.12725    51.4   10.97633 1.263030          ?        ? 
1 1 1    8   40    9 o 40.60839 1.666216   33.77224   124.2   16.75019 1.353247          ?        ? 
1 1 1    8   40   10 o 18.14002 3.524210   17.20201   281.5   3.638730 1.232958          ?        ? 
1 1 1    8   40   11 o 10.38906 4.075674   10.09937    79.5  0.9021643 1.232958          ?        ? 
1 1 1    8   40   12 o 39.62179 1.783603   34.18952   123.4   16.14874 1.413391          ?        ? 
1 1 1    8   40   13 o 22.56179 3.132266   18.93921   315.9   5.683635 1.413391          ?        ? 
1 1 1    8   41    0 o 120.0743 1.791583   93.16148   180.0   145.0079 4.300317   145.0079 4.300317 
1 1 1    8   41    1 o 40.71105 1.477346   39.04264    33.1   16.69004 1.202886          ?        ? 
1 1 1    8   41    2 o 60.15866 1.174719   48.99653   108.5   36.35722 1.413391          ?        ? 
1 1 1    8   41    3 o 30.64833 1.815220   33.03695   119.6   9.502798 1.112669          ?        ? 
1 1 1    8   41    4 o 54.94236 1.395717   51.17996   195.7   30.40294 1.533679          ?        ? 
1 1 1    8   41    5 o 35.37331 1.742780   32.31660    54.0   12.66037 1.232958          ?        ? 
1 1 1    8   41    6 o 33.76938 1.781030   32.12602   266.8   11.57778 1.202886          ?        ? 
1 1 1    8   41    7 o 31.25258 2.068793   32.21040    93.3   9.983953 1.293102          ?        ? 
1 1 1    8   41    8 o 11.00420 4.133958   15.90645   147.2   1.112669 1.232958          ?        ? 
1 1 1    8   41    9 o 13.29304 3.920808   12.53922    35.7   1.984761 1.112669          ?        ? 
1 1 1    8   41   10 o 11.15547 4.056517   12.42761   244.9   1.263030 1.172814          ?        ? 
1 1 1    8   41   11 o 41.63811 1.733343   42.65515    86.5   17.80271 1.443463          ?        ? 
1 1 1    8   41   12 o 29.14256 2.373366   28.25310   276.4   9.051716 1.383319          ?        ? 
1 1 1    8   42    0 f 33.07473 2.482678   16.95969   360.0   11.24698 1.623896   11.24698 1.623896 
1 1 1    8   42    1 o 57.88562 1.168897   47.32898   172.6   33.68080 1.353247          ?        ? 
1 1 1    8   42    2 o 38.32713 1.530005   31.16002   279.2   14.82557 1.172814          ?        ? 
1 1 1    8   42    3 o 37.63472 1.558154   30.68586   295.3   14.31434 1.172814          ?        ? 
1 1 1    8   42    4 f 23.26973 2.584658   33.31149   211.2   5.593419 1.202886          ?        ? 
1 1 1    8   42    5 o 19.88336 3.100477   18.32951   166.7   4.149956 1.232958          ?        ? 
1 1 1    8   42    6 o 25.36789 2.430155   18.84331     1.1   6.645944 1.232958          ?        ? 
1 1 1    8   42    7 o 27.37947 2.361446   20.53154     8.6   7.758613 1.293102          ?        ? 
1 1 1    8   42    8 o 9.583821 3.960263   12.64485   172.3  0.4811543 1.232958          ?        ? 
1 1 1    8   42    9 o 17.72758 3.840242   22.20195   142.9   3.608657 1.323174          ?        ? 
1 1 1    8   42   10 o 7.034085 3.318120   7.104422   183.7  -1.112669 1.232958          ?        ? 
1 1 1    8   42   11 o 10.43891 4.079663   11.16473   259.6   1.082597 1.232958          ?        ? 
1 1 1    8   42   12 o 16.78203 3.766357   7.580575   129.5   3.428224 1.232958          ?        ? 
1 1 1    8   43    0 o 53.70639 1.852615   41.86282     0.0   29.20005 1.984761   29.20005 1.984761 
1 1 1    8   43    1 o 17.08457 3.198702   8.927628    57.7   3.157575 1.052525          ?        ? 
1 1 1    8   43    2 o 46.91135 1.378240   43.02609   226.0   22.22332 1.293102          ?        ? 
1 1 1    8   43    3 o 28.36639 1.961246   19.00834    79.6   8.209695 1.112669          ?        ? 
1 1 1    8   43    4 o 8.027957 3.622619   8.260847   164.8 -0.4510822 1.232958          ?        ? 
1 1 1    8   43    5 o 80.43483 1.233770   66.58395    21.1   65.31670 1.984761          ?        ? 
1 1 1    8   43    6 o 13.64717 4.209979   14.62926   304.7   2.105050 1.263030          ?        ? 
1 1 1    8   43    7 o 24.49297 2.332795   22.94258    18.9   6.224934 1.142741          ?        ? 
1 1 1    8   43    8 o 25.47789 2.596711   26.88467   207.6   6.856449 1.323174          ?        ? 
1 1 1    8   43    9 o 22.55778 2.866200   18.61728    31.2   5.473131 1.293102          ?        ? 
1 1 1    8   43   10 o 7.426902 3.465783   4.621613   187.5 -0.7518036 1.263030          ?        ? 
1 1 1    8   43   11 o 35.42013 1.952729   30.89004   323.8   13.17160 1.383319          ?        ? 
1 1 1    8   44    0 o 8.056965 4.972582   4.526005   180.0  0.7217315 1.533679  0.7217315 1.533679 
1 1 1    8   44    1 o 26.45982 2.216216   27.60782    25.7   7.217315 1.172814          ?        ? 
1 1 1    8   44    2 o 8.667837 3.653195   7.163472   348.1  0.2405772 1.082597          ?        ? 
1 1 1    8   44    3 o 42.62508 1.446282   40.15498   166.9   18.40415 1.232958          ?        ? 
1 1 1    8   44    4 o 6.350569 3.093166   3.569525   277.2  -2.044906 1.263030          ?        ? 
1 1 1    8   44    5 o 13.67387 4.086775   13.61703   222.3   2.135122 1.202886          ?        ? 
1 1 1    8   44    6 o 12.07039 4.227172   16.87313   116.0   1.593824 1.263030          ?        ? 
1 1 1    8   44    7 o 16.20379 4.007317   16.51144   173.9   3.097431 1.293102          ?        ? 
1 1 1    8   44    8 o 23.69128 2.792535   21.72039   350.8   6.044501 1.323174          ?        ? 
1 1 1    8   44    9 o 39.48616 1.865888   35.37159   301.9   16.23896 1.473535          ?        ? 
1 1 1    8   45    0 o 21.05345 4.072171   18.50649   180.0   5.082192 1.533679   5.082192 1.533679 
1 1 1    8   45    1 o 24.71948 2.372246   23.84923   108.7   6.345222 1.172814          ?        ? 
1 1 1    8   45    2 o 50.01353 1.382944   35.95306    98.9   25.35082 1.383319          ?        ? 
1 1 1    8   45    3 o 28.30973 2.177622   28.07405   112.1   8.299912 1.232958          ?        ? 
1 1 1    8   45    4 o 22.14556 2.851655   22.75066   234.2   5.232553 1.263030          ?        ? 
1 1 1    8   45    5 o 48.00141 1.534887   36.74933   246.1   23.51642 1.473535          ?        ? 
1 1 1    8   45    6 o 13.98665 4.189208   9.561735   250.1   2.345627 1.263030          ?        ? 
1 1 1    8   45    7 o 15.24837 4.065867   20.60384   203.6   2.856854 1.263030          ?        ? 
1 1 1    8   45    8 o 13.27032 4.336610   6.988468    93.7   2.225339 1.323174          ?        ? 
1 1 1    8   46    0 o 31.01303 2.705841   28.13488     0.0   10.13431 1.653968   10.13431 1.653968 
1 1 1    8   46    1 o 11.04621 3.957575   3.438065   232.8   1.293102 1.112669          ?        ? 
1 1 1    8   46    2 o 22.93126 2.557237   19.90380    83.3   5.563347 1.172814          ?        ? 
1 1 1    8   46    3 o 9.881273 3.830778   11.72946   189.6  0.8720922 1.082597          ?        ? 
1 1 1    8   46    4 o 36.45963 1.855815   30.78856   281.1   13.74297 1.353247          ?        ? 
1 1 1    8   46    5 o 28.45673 2.272050   15.37906   231.0   8.570561 1.293102          ?        ? 
1 1 1    8   46    6 o 20.66695 3.055676   21.48755   351.7   4.751399 1.263030          ?        ? 
1 1 1    8   46    7 o 28.93187 2.390648   24.40126   326.6   8.991571 1.383319          ?        ? 
1 1 1    8   47    0 o 42.77950 2.262833   37.40410   180.0   18.97552 1.924617   18.97552 1.924617 
1 1 1    8   47    1 o 37.17677 1.658237   27.88455    70.1   14.25420 1.232958          ?        ? 
1 1 1    8   47    2 o 11.14772 4.009031   2.118163   165.0   1.413391 1.142741          ?        ? 
1 1 1    8   47    3 o 24.74612 2.430453   17.79287    70.7   6.555727 1.202886          ?        ? 
1 1 1    8   47    4 o 12.90308 4.185788   12.48014    42.5   2.074978 1.232958          ?        ? 
1 1 1    8   47    5 o 11.33137 4.198425   8.094796   258.9   1.503607 1.263030          ?        ? 
1 1 1    8   48    0 o 32.94725 2.586995   28.16164   360.0   11.51763 1.684040   11.51763 1.684040 
1 1 1    8   48    1 o 25.06857 2.339211   18.54370   299.6   6.736160 1.172814          ?        ? 
1 1 1    9    0    1 o 314.8546 2.798975   296.5061   270.0   991.9297 17.62228   991.9297 17.62228 
1 1 1    9    0    2 o 60.12923 0.8255553   17.46526    90.0   36.17679 0.9923807   36.17679 0.9923807 
1 1 1    9    0    3 o 162.6913 1.571484   43.54319    90.0   264.7852 5.112265   264.7852 5.112265 
1 1 1    9    0    4 o 100.2918 1.049721   78.18969    90.0   100.6214 2.105050   100.6214 2.105050 
1 1 1    9    0    5 o 15.51532 0.9770892   72.79195   270.0   2.435844 0.3007214   2.435844 0.3007214 
1 1 1    9    0    6 o 67.24918 1.051436   103.4408   270.0   45.25858 1.413391   45.25858 1.413391 
1 1 1    9    0    7 o 73.54436 1.166015   12.72029    90.0   54.12986 1.714112   54.12986 1.714112 
1 1 1    9    0    8 o 194.8999 1.851919   223.7772    90.0   379.9916 7.217315   379.9916 7.217315 
1 1 1    9    0    9 o 136.9135 1.735809   140.2163   270.0   187.5600 4.751399   187.5600 4.751399 
1 1 1    9    0   10 o 40.79522 1.590120   82.31091    90.0   16.72011 1.293102   16.72011 1.293102 
1 1 1    9    0   11 o 181.8786 2.050824   134.2052   270.0   331.0041 7.457891   331.0041 7.457891 
1 1 1    9    0   12 o 8.154805 4.364255   5.153494    90.0  0.9623086 0.9623086  0.9623086 0.9623086 
1 1 1    9    0   13 o 160.5928 1.826287   193.0754   270.0   258.1092 5.864068   258.1092 5.864068 
1 1 1    9    0   14 o 151.8407 1.783007   182.8660   270.0   230.7737 5.412986   230.7737 5.412986 
1 1 1    9    0   15 o 112.3609 1.552970   122.7138    90.0   126.3932 3.488369   126.3932 3.488369 
1 1 1    9    0   16 o 43.11300 1.573997   20.97157    90.0   18.67480 1.353247   18.67480 1.353247 
1 1 1    9    0   17 o 5.381200 3.701050   14.75679   270.0 -0.7217315 1.232958 -0.7217315 1.232958 
1 1 1    9    0   18 o 9.619837 5.652670   17.06548   270.0   1.142741 1.804329   1.142741 1.804329 
1 1 1    9    0   19 o 124.4901 1.788390   129.0546   270.0   155.4128 4.450677   155.4128 4.450677 
1 1 1    9    0   20 o 36.64553 2.653872   50.82907   270.0   13.74297 1.924617   13.74297 1.924617 
1 1 1    9    0   21 o 10.09335 6.002298   10.73226    90.0   1.323174 2.074978   1.323174 2.074978 
1 1 1    9    0   22 o 6.289892 4.363128   9.770928    90.0  -1.022453 1.774257  -1.022453 1.774257 
1 1 1    9    0   23 o 5.269686 3.812436   6.897317   270.0  -2.646349 1.864473  -2.646349 1.864473 
1 1 1    9    0   24 o 16.80700 5.852046   26.78384    90.0   4.119884 1.774257   4.119884 1.774257 
1 1 1    9    1    0 o 298.3802 2.696484   484.2228   180.0   890.8271 16.08860   890.8271 16.08860 
1 1 1    9    1    1 o 154.7472 1.117402   227.2758   200.6   239.4946 3.458297          ?        ? 
1 1 1    9    1    2 o 124.4066 0.9064677   279.9443   290.1   154.7813 2.255411          ?        ? 
1 1 1    9    1    3 f 61.38351 0.5878872   79.46904    58.0   37.68040 0.7217315          ?        ? 
1 1 1    9    1    4 o 319.6279 1.900514   494.1955   268.9   1021.882 12.14915          ?        ? 
1 1 1    9    1    5 o 129.1982 0.9775912   108.3684   316.1   166.9305 2.526060          ?        ? 
1 1 1    9    1    6 f 413.9655 2.840384   437.3601   347.5   1714.172 23.51642          ?        ? 
1 1 1    9    1    7 o 156.9612 1.187856   145.0939   325.9   246.3811 3.728946          ?        ? 
1 1 1    9    1    8 o 122.8393 1.015956   66.50877   356.8   150.9020 2.495988          ?        ? 
1 1 1    9    1    9 o 245.9945 1.662562   224.8662   249.0   605.2320 8.179624          ?        ? 
1 1 1    9    1   10 o 263.2762 1.918943   358.2117    52.8   693.3734 10.10424          ?        ? 
1 1 1    9    1   11 o 252.8281 1.891194   248.3913   236.3   639.4841 9.562942          ?        ? 
1 1 1    9    1   12 o 45.71233 1.019677   84.72066    21.7   20.90014 0.9322364          ?        ? 
1 1 1    9    1   13 o 161.9560 1.299767   167.2136   131.8   262.4095 4.210100          ?        ? 
1 1 1    9    1   14 o 78.84905 0.9153332   134.0834   127.7   62.18920 1.443463          ?        ? 
1 1 1    9    1   15 o 68.60999 0.9423571   80.11530   314.3   47.09298 1.293102          ?        ? 
1 1 1    9    1   16 f 19.51255 2.311754   27.32014    80.9   3.819162 0.9021643          ?        ? 
1 1 1    9    1   17 o 70.45905 1.024328   78.61954   201.1   49.67918 1.443463          ?        ? 
1 1 1    9    1   18 o 34.94679 1.505897   44.86642   142.3   12.23936 1.052525          ?        ? 
1 1 1    9    1   19 o 60.60298 1.265350   62.84122   304.2   36.80830 1.533679          ?        ? 
1 1 1    9    1   20 o 49.64626 1.544607   53.78532   332.7   24.77945 1.533679          ?        ? 
1 1 1    9    1   21 o 26.15206 2.184802   30.70933    26.9   6.946666 1.142741          ?        ? 
1 1 1    9    1   22 x        ?      ?   15.75943   121.8          ?        ?          ?        ? 
1 1 1    9    1   23 o 36.43354 3.260319   31.05598   336.3   14.22412 2.375700          ?        ? 
1 1 1    9    1   24 o 14.74648 5.490389   16.59987   206.8   2.916998 2.165194          ?        ? 
1 1 1    9    2    0 o 193.0868 1.838156   231.7607     0.0   372.9848 7.097026   372.9848 7.097026 
1 1 1    9    2    1 o 178.6367 1.237317   136.2264    17.0   319.1557 4.420605          ?        ? 
1 1 1    9    2    2 o 168.3618 1.152074   169.3309   143.8   283.4901 3.879307          ?        ? 
1 1 1    9    2    3 o 141.3129 1.000185   276.7251    24.5   199.7091 2.826782          ?        ? 
1 1 1    9    2    4 o 95.97240 0.7833540   62.00232    36.1   92.11098 1.503607          ?        ? 
1 1 1    9    2    5 f 197.0012 1.503598   184.1430   252.0   388.1411 5.924213          ?        ? 
1 1 1    9    2    6 o 175.3230 1.209246   166.3064   271.1   307.3975 4.240172          ?        ? 
1 1 1    9    2    7 o 598.9071 3.974257   754.3606     7.0   3589.050 47.60421          ?        ? 
1 1 1    9    2    8 o 206.0951 1.575871   246.3746   220.3   424.7991 6.495584          ?        ? 
1 1 1    9    2    9 f 255.5264 1.888876   305.3716    50.2   653.0768 9.653158          ?        ? 
1 1 1    9    2   10 f 258.8492 2.015659   332.7421   323.3   670.2780 10.43503          ?        ? 
1 1 1    9    2   11 o 56.48317 0.9050953   95.12623   343.4   31.90655 1.022453          ?        ? 
1 1 1    9    2   12 o 116.6249 1.147449   156.7270    64.2   136.0464 2.676421          ?        ? 
1 1 1    9    2   13 f 162.2142 1.325505   176.2113   123.9   263.2516 4.300317          ?        ? 
1 1 1    9    2   14 o 28.53897 1.317153   47.51630   122.0   8.149551 0.7518036          ?        ? 
1 1 1    9    2   15 o 41.06482 0.9520020   38.78979   299.0   16.87047 0.7818757          ?        ? 
1 1 1    9    2   16 o 80.21724 0.9934422   76.20953    53.7   64.38446 1.593824          ?        ? 
1 1 1    9    2   17 o 56.46025 1.171775   64.55910   160.6   31.90655 1.323174          ?        ? 
1 1 1    9    2   18 o 60.79659 1.261320   49.71854   329.2   37.01881 1.533679          ?        ? 
1 1 1    9    2   19 o 40.74448 1.586844   26.42660   258.4   16.65997 1.293102          ?        ? 
1 1 1    9    2   20 o 37.45191 1.565760   51.54277   104.6   14.10384 1.172814          ?        ? 
1 1 1    9    2   21 f 46.65153 1.482608   48.68804    86.1   21.92259 1.383319          ?        ? 
1 1 1    9    2   22 o 34.59127 2.216859   33.80463   221.1   12.26943 1.533679          ?        ? 
1 1 1    9    2   23 o 31.41625 2.488762   28.50451   294.4   10.28467 1.563751          ?        ? 
1 1 1    9    2   24 o 20.13569 5.462441   24.16258    74.6   5.593419 2.255411          ?        ? 
1 1 1    9    3    0 o 107.7127 1.284677   206.3881   180.0   116.0785 2.766637   116.0785 2.766637 
1 1 1    9    3    1 o 161.4788 1.154624   251.6821   107.1   260.7856 3.728946          ?        ? 
1 1 1    9    3    2 o 99.11623 0.8040176   217.7131    45.0   98.24570 1.593824          ?        ? 
1 1 1    9    3    3 o 31.31024 0.5282515   32.34064   233.0   9.803518 0.3307936          ?        ? 
1 1 1    9    3    4 o 344.5176 2.417869   387.2170   119.5   1187.399 16.65997          ?        ? 
1 1 1    9    3    5 o 276.3428 1.980559   368.8885   175.9   763.8024 10.94626          ?        ? 
1 1 1    9    3    6 o 144.2633 1.198606   240.2170   161.5   208.1293 3.458297          ?        ? 
1 1 1    9    3    7 f 285.5551 2.090427   305.1869   125.2   815.5566 11.93864          ?        ? 
1 1 1    9    3    8 o 290.7367 2.104888   293.5401   121.5   845.4482 12.23936          ?        ? 
1 1 1    9    3    9 o 348.3367 2.464741   379.3403   190.9   1213.832 17.17119          ?        ? 
1 1 1    9    3   10 o 359.4520 2.530748   439.8879   171.1   1292.832 18.19365          ?        ? 
1 1 1    9    3   11 o 53.95077 0.9197095   62.83055   287.0   29.10984 0.9923807          ?        ? 
1 1 1    9    3   12 o 126.8251 1.161864   168.2841    37.9   160.8860 2.947070          ?        ? 
1 1 1    9    3   13 o 133.7884 1.112631   195.0327    21.3   179.0496 2.977142          ?        ? 
1 1 1    9    3   14 o 85.50564 0.9495841   67.86982   292.5   73.13545 1.623896          ?        ? 
1 1 1    9    3   15 o 52.92883 0.9658753   64.11263    75.9   28.02724 1.022453          ?        ? 
1 1 1    9    3   16 o 107.9369 1.142295   141.6966   257.4   116.5897 2.465916          ?        ? 
1 1 1    9    3   17 o 115.0912 1.463222   125.2130   263.8   132.6482 3.368080          ?        ? 
1 1 1    9    3   18 o 63.71878 1.203475   42.90014   123.5   40.65754 1.533679          ?        ? 
1 1 1    9    3   19 o 21.62485 2.572664   38.26352   119.7   4.721327 1.112669          ?        ? 
1 1 1    9    3   20 o 44.49658 1.554410   52.84317    47.1   19.90776 1.383319          ?        ? 
1 1 1    9    3   21 o 20.71755 2.975636   24.17311   108.4   4.420605 1.232958          ?        ? 
1 1 1    9    3   22 o 35.11492 2.055341   40.32979   171.2   12.60023 1.443463          ?        ? 
1 1 1    9    3   23 o 27.97852 2.203401   31.35586   293.7   8.089407 1.232958          ?        ? 
1 1 1    9    3   24 o 40.28336 1.642334   34.99561    54.5   16.72011 1.323174          ?        ? 
1 1 1    9    4    0 o 368.0355 3.792243   267.7711   180.0   1355.803 27.90695   1355.803 27.90695 
1 1 1    9    4    1 o 269.9711 1.876926   370.1664    70.2   729.0690 10.13431          ?        ? 
1 1 1    9    4    2 o 252.9546 1.771365   300.7473   138.6   640.0255 8.961499          ?        ? 
1 1 1    9    4    3 o 107.6389 0.8800468   169.9391   142.7   115.8680 1.894545          ?        ? 
1 1 1    9    4    4 o 69.40732 0.7582235   238.1264    43.7   48.17558 1.052525          ?        ? 
1 1 1    9    4    5 o 71.73002 0.7965574   159.3145    20.5   51.45344 1.142741          ?        ? 
1 1 1    9    4    6 o 278.5879 2.029364   338.2845   330.7   776.2222 11.30713          ?        ? 
1 1 1    9    4    7 o 80.05111 0.8640221   116.5291   279.7   64.08374 1.383319          ?        ? 
1 1 1    9    4    8 o 206.2260 1.574870   201.9108   309.5   425.3404 6.495584          ?        ? 
1 1 1    9    4    9 o 341.3965 2.382718   382.5618    24.5   1165.927 16.26903          ?        ? 
1 1 1    9    4   10 o 144.3489 1.302060   100.9848   184.2   208.4000 3.759018          ?        ? 
1 1 1    9    4   11 o 112.4830 1.096128   132.3929   163.8   126.5436 2.465916          ?        ? 
1 1 1    9    4   12 o 43.59166 0.9658041   44.48344     4.0   19.00560 0.8420200          ?        ? 
1 1 1    9    4   13 o 44.27313 1.086786   79.56883   167.6   19.60704 0.9623086          ?        ? 
1 1 1    9    4   14 o 40.28684 1.194321   25.43281     7.6   16.23896 0.9623086          ?        ? 
1 1 1    9    4   15 o 170.2143 1.501714   205.2176   238.5   290.0458 5.112265          ?        ? 
1 1 1    9    4   16 o 97.49216 1.156714   113.2255   203.3   95.11819 2.255411          ?        ? 
1 1 1    9    4   17 o 109.5176 1.304290   139.8130   302.2   120.0781 2.856854          ?        ? 
1 1 1    9    4   18 o 51.22936 1.232721   52.74908   304.1   26.28305 1.263030          ?        ? 
1 1 1    9    4   19 o 11.94411 4.082783   16.77696    13.3   1.353247 1.172814          ?        ? 
1 1 1    9    4   20 o 76.04423 1.265459   81.72374   308.7   58.03924 1.924617          ?        ? 
1 1 1    9    4   21 o 47.19692 1.433617   61.12704    78.5   22.43382 1.353247          ?        ? 
1 1 1    9    4   22 o 58.88261 1.736426   58.60695   209.4   35.21448 2.044906          ?        ? 
1 1 1    9    4   23 o 20.19418 3.937814   17.88265   102.7   4.631110 1.533679          ?        ? 
1 1 1    9    4   24 o 24.66267 2.987380   23.35130   266.6   6.706088 1.473535          ?        ? 
1 1 1    9    5    0 o 293.5156 3.059028   520.7374     0.0   862.1383 17.95307   862.1383 17.95307 
1 1 1    9    5    1 o 270.9883 2.041887   355.0092   345.1   734.6024 11.06655          ?        ? 
1 1 1    9    5    2 o 27.47328 0.7114875   23.42529   262.8   7.548109 0.3909379          ?        ? 
1 1 1    9    5    3 o 282.5576 2.038103   399.4469   149.0   798.6259 11.51763          ?        ? 
1 1 1    9    5    4 o 108.5705 0.9971371   172.2700   146.2   117.8828 2.165194          ?        ? 
1 1 1    9    5    5 f 587.4205 4.264424   582.4896   150.8   3453.214 50.10020          ?        ? 
1 1 1    9    5    6 o 163.6209 1.249783   235.0292   124.7   267.7323 4.089812          ?        ? 
1 1 1    9    5    7 o 82.07248 0.9709855   129.6098   349.2   67.36160 1.593824          ?        ? 
1 1 1    9    5    8 o 392.2400 2.978541   396.2249    42.0   1539.182 23.36606          ?        ? 
1 1 1    9    5    9 o 88.43777 1.020112   104.5941   330.6   78.21765 1.804329          ?        ? 
1 1 1    9    5   10 o 164.5324 1.507881   148.2976    59.3   270.7696 4.961904          ?        ? 
1 1 1    9    5   11 f 126.6849 1.258101   186.8328    30.7   160.5251 3.187647          ?        ? 
1 1 1    9    5   12 o 159.3877 1.415047   163.1736   314.5   254.1397 4.510822          ?        ? 
1 1 1    9    5   13 o 73.25712 0.9441530   97.51982    95.8   53.67878 1.383319          ?        ? 
1 1 1    9    5   14 o 131.7789 1.198058   146.2499    54.0   173.7569 3.157575          ?        ? 
1 1 1    9    5   15 o 125.5313 1.245706   148.0597   208.0   157.6983 3.127503          ?        ? 
1 1 1    9    5   16 o 40.39151 1.265678   31.62394   254.0   16.32917 1.022453          ?        ? 
1 1 1    9    5   17 o 161.5503 1.554330   171.1608    32.1   261.4171 5.022048          ?        ? 
1 1 1    9    5   18 o 46.29734 1.331564   47.63720   326.2   21.47151 1.232958          ?        ? 
1 1 1    9    5   19 o 75.25504 1.138869   75.20765    32.1   56.74614 1.714112          ?        ? 
1 1 1    9    5   20 o 54.58485 1.349766   47.53625   293.6   29.92178 1.473535          ?        ? 
1 1 1    9    5   21 o 36.12928 1.789549   35.03110   212.3   13.20167 1.293102          ?        ? 
1 1 1    9    5   22 o 40.30127 2.052005   39.25365   110.8   16.59982 1.653968          ?        ? 
1 1 1    9    5   23 f 31.22245 2.600526   17.65996    15.9   10.22453 1.623896          ?        ? 
1 1 1    9    5   24 o 8.001492 3.754821   3.804805   118.6 -0.9623086 1.533679          ?        ? 
1 1 1    9    6    0 o 366.6679 3.712017   378.6193   180.0   1345.608 27.21529   1345.608 27.21529 
1 1 1    9    6    1 o 137.1288 1.381581   182.1351   337.7   188.0712 3.789090          ?        ? 
1 1 1    9    6    2 o 72.83143 0.8877365   217.4624    34.5   53.04726 1.293102          ?        ? 
1 1 1    9    6    3 o 194.8798 1.519966   123.2931   208.2   379.8412 5.924213          ?        ? 
1 1 1    9    6    4 o 284.8508 2.063924   216.8385    64.8   811.5870 11.75821          ?        ? 
1 1 1    9    6    5 o 136.2551 1.246981   306.3979    14.2   185.6654 3.398152          ?        ? 
1 1 1    9    6    6 o 290.7079 2.063719   412.1277    78.0   845.2377 11.99879          ?        ? 
1 1 1    9    6    7 o 178.7680 1.387805   177.7332   345.1   319.6068 4.961904          ?        ? 
1 1 1    9    6    8 o 253.6294 1.861506   296.9777   134.7   643.3936 9.442654          ?        ? 
1 1 1    9    6    9 o 92.28168 0.9450330   142.1381   120.3   85.16431 1.744184          ?        ? 
1 1 1    9    6   10 o 92.18211 0.9949874   99.83610   284.5   84.98388 1.834401          ?        ? 
1 1 1    9    6   11 o 112.5761 1.041796   149.5178   205.7   126.7541 2.345627          ?        ? 
1 1 1    9    6   12 o 117.2141 1.192992   132.7293   292.3   137.4297 2.796710          ?        ? 
1 1 1    9    6   13 o 64.99274 0.9485353   115.5440   121.8   42.25136 1.232958          ?        ? 
1 1 1    9    6   14 o 28.85044 1.355050   42.08749   166.7   8.329985 0.7818757          ?        ? 
1 1 1    9    6   15 o 71.56844 0.9664306   68.30322   121.5   51.24293 1.383319          ?        ? 
1 1 1    9    6   16 o 37.81290 1.431518   41.50331    67.7   14.31434 1.082597          ?        ? 
1 1 1    9    6   17 o 114.4282 1.379719   119.9515   121.9   131.1145 3.157575          ?        ? 
1 1 1    9    6   18 o 22.74808 2.313437   15.25950   341.8   5.202481 1.052525          ?        ? 
1 1 1    9    6   19 o 12.87138 4.186159   17.88684   293.5   1.653968 1.232958          ?        ? 
1 1 1    9    6   20 o 48.20760 1.309991   55.82101   114.2   23.33598 1.263030          ?        ? 
1 1 1    9    6   21 o 28.68952 2.515663   31.33117   298.0   8.420200 1.443463          ?        ? 
1 1 1    9    6   22 o 15.09980 4.407964   19.27367   305.0   2.586205 1.413391          ?        ? 
1 1 1    9    6   23 o 30.85464 2.192938   36.29963   213.8   9.863664 1.353247          ?        ? 
1 1 1    9    6   24 o 30.13677 2.744103   26.24850   324.3   9.893736 1.653968          ?        ? 
1 1 1    9    7    0 o 161.9626 2.461445   189.9484    -0.0   262.5599 7.969118   262.5599 7.969118 
1 1 1    9    7    1 o 297.3350 2.831890   446.2142   255.1   884.6022 16.84040          ?        ? 
1 1 1    9    7    2 o 171.0614 1.432749   360.5672   299.0   292.6621 4.901759          ?        ? 
1 1 1    9    7    3 o 362.9932 2.564050   374.5876   203.1   1318.182 18.61466          ?        ? 
1 1 1    9    7    4 o 321.8611 2.289085   359.8193   319.2   1036.196 14.73535          ?        ? 
1 1 1    9    7    5 o 677.1195 4.132524   826.0710   292.1   4587.656 55.96426          ?        ? 
1 1 1    9    7    6 o 157.0190 1.139539   116.7395   317.7   246.5615 3.578585          ?        ? 
1 1 1    9    7    7 o 97.14081 0.8513251   161.1450   229.4   94.36639 1.653968          ?        ? 
1 1 1    9    7    8 o 108.5430 1.025096   23.67979   174.3   117.8227 2.225339          ?        ? 
1 1 1    9    7    9 o 224.9920 1.697466   254.9412   196.1   506.3247 7.638325          ?        ? 
1 1 1    9    7   10 o 143.9536 1.201185   156.9859   274.3   207.2572 3.458297          ?        ? 
1 1 1    9    7   11 o 219.2831 1.659376   297.9416   271.8   481.0641 7.277459          ?        ? 
1 1 1    9    7   12 o 41.28815 1.019687   40.97609   172.7   17.05091 0.8420200          ?        ? 
1 1 1    9    7   13 o 74.13430 0.8721350   94.42987    17.0   54.97188 1.293102          ?        ? 
1 1 1    9    7   14 o 49.13058 0.9793378   44.01152   119.8   24.14793 0.9623086          ?        ? 
1 1 1    9    7   15 o 68.43295 0.9887391   76.10268   315.7   46.85240 1.353247          ?        ? 
1 1 1    9    7   16 o 64.02808 0.9863096   64.74353   302.8   41.01840 1.263030          ?        ? 
1 1 1    9    7   17 o 45.72588 1.183791   54.19675   187.2   20.93021 1.082597          ?        ? 
1 1 1    9    7   18 o 96.66333 1.213297   97.03293   315.7   93.58452 2.345627          ?        ? 
1 1 1    9    7   19 o 63.49211 1.302499   71.39550    48.8   40.41696 1.653968          ?        ? 
1 1 1    9    7   20 o 29.64847 2.231438   30.43810    77.9   8.901355 1.323174          ?        ? 
1 1 1    9    7   21 o 37.04052 2.151459   23.22096   179.2   13.95348 1.593824          ?        ? 
1 1 1    9    7   22 o 23.74453 3.166219   36.25507   142.1   5.954284 1.503607          ?        ? 
1 1 1    9    7   23 o 41.92189 2.116146   51.71218   210.3   18.19365 1.774257          ?        ? 
1 1 1    9    7   24 o 31.03702 2.373835   27.00251   266.2   10.28467 1.473535          ?        ? 
1 1 1    9    8    0 o 613.6767 7.362663   691.8229    -0.0   3774.776 90.33672   3774.776 90.33672 
1 1 1    9    8    1 o 51.02974 1.090217   86.16123    93.5   26.04248 1.112669          ?        ? 
1 1 1    9    8    2 o 118.7922 1.177143   140.3247    49.8   141.1286 2.796710          ?        ? 
1 1 1    9    8    3 o 276.3664 2.214337   285.1221   352.8   763.9828 12.23936          ?        ? 
1 1 1    9    8    4 o 347.7239 2.482057   431.3581   221.9   1209.411 17.26141          ?        ? 
1 1 1    9    8    5 o 315.2787 2.084113   385.3620    76.0   994.1550 13.14153          ?        ? 
1 1 1    9    8    6 o 144.7211 1.111696   139.2972   286.4   209.4525 3.217719          ?        ? 
1 1 1    9    8    7 o 117.3048 0.9741640   155.7629   151.8   137.6101 2.285483          ?        ? 
1 1 1    9    8    8 o 350.8118 2.447351   391.8800    94.6   1231.124 17.17119          ?        ? 
1 1 1    9    8    9 o 161.7183 1.329570   207.2789     3.1   261.5675 4.300317          ?        ? 
1 1 1    9    8   10 o 75.24673 0.9191885   98.62538   188.0   56.62585 1.383319          ?        ? 
1 1 1    9    8   11 o 206.1836 1.618950   217.3731    61.6   425.3104 6.676016          ?        ? 
1 1 1    9    8   12 f 157.7459 1.296329   201.1396   326.6   248.9372 4.089812          ?        ? 
1 1 1    9    8   13 o 73.56243 0.9402345   52.74413   298.8   54.12986 1.383319          ?        ? 
1 1 1    9    8   14 o 93.20594 1.000190   109.4361    93.0   86.90850 1.864473          ?        ? 
1 1 1    9    8   15 o 97.48962 0.9716652   126.6506   178.0   95.08813 1.894545          ?        ? 
1 1 1    9    8   16 o 125.6785 1.076752   139.7861   266.6   158.0592 2.706493          ?        ? 
1 1 1    9    8   17 o 163.6040 1.387770   180.8042   275.2   268.0631 4.540894          ?        ? 
1 1 1    9    8   18 o 71.49438 1.072587   80.61370   209.6   51.18279 1.533679          ?        ? 
1 1 1    9    8   19 o 68.20953 1.080153   66.01177    27.0   46.61182 1.473535          ?        ? 
1 1 1    9    8   20 o 60.62873 1.190412   77.79602   109.6   36.89852 1.443463          ?        ? 
1 1 1    9    8   21 o 14.01337 3.622587   16.42036   344.9   2.135122 1.022453          ?        ? 
1 1 1    9    8   22 o 49.16093 1.468100   49.85575   122.5   24.47873 1.443463          ?        ? 
1 1 1    9    8   23 o 25.00046 3.067303   18.41071   233.8   6.736160 1.533679          ?        ? 
1 1 1    9    8   24 f 22.00566 2.664800   29.10185   264.0   5.262625 1.172814          ?        ? 
1 1 1    9    9    0 f 25.85169 1.941113   30.27652   360.0   6.796305 0.9923807   6.796305 0.9923807 
1 1 1    9    9    1 o 308.9580 2.579354   333.3926    52.9   954.9410 15.93824          ?        ? 
1 1 1    9    9    2 o 282.4217 2.273340   341.7989    16.1   797.8441 12.84081          ?        ? 
1 1 1    9    9    3 o 205.8949 1.811092   154.9783   313.0   423.9872 7.457891          ?        ? 
1 1 1    9    9    4 o 429.4390 2.951621   470.8422    15.3   1844.746 25.35082          ?        ? 
1 1 1    9    9    5 o 105.7373 1.052296   128.5633   338.4   111.8082 2.225339          ?        ? 
1 1 1    9    9    6 o 206.8761 1.468168   334.5864   103.0   428.0168 6.074574          ?        ? 
1 1 1    9    9    7 o 68.16167 0.7720799   110.2505    93.2   46.46146 1.052525          ?        ? 
1 1 1    9    9    8 o 178.1847 1.307964   228.0910   316.7   317.5318 4.661182          ?        ? 
1 1 1    9    9    9 o 254.2151 1.851302   226.4760   357.7   646.4609 9.412581          ?        ? 
1 1 1    9    9   10 o 125.2206 1.152736   83.61525    94.2   156.8262 2.886926          ?        ? 
1 1 1    9    9   11 o 186.3319 1.476720   230.0967   272.4   347.3333 5.503202          ?        ? 
1 1 1    9    9   12 o 82.64820 0.9824145   112.7487    34.9   68.32391 1.623896          ?        ? 
1 1 1    9    9   13 o 51.34719 0.9663439   85.99519    94.0   26.37327 0.9923807          ?        ? 
1 1 1    9    9   14 o 90.17405 0.9837956   133.7293    67.5   81.34515 1.774257          ?        ? 
1 1 1    9    9   15 o 29.25819 1.438948   53.69947   117.2   8.570561 0.8420200          ?        ? 
1 1 1    9    9   16 o 80.90459 1.003587   81.61491   298.9   65.49713 1.623896          ?        ? 
1 1 1    9    9   17 o 58.34419 1.056624   47.28188   190.1   34.07174 1.232958          ?        ? 
1 1 1    9    9   18 o 20.26767 2.893312   36.21426   331.5   4.149956 1.172814          ?        ? 
1 1 1    9    9   19 o 12.09952 3.731586   13.00406   215.6   1.503607 0.9923807          ?        ? 
1 1 1    9    9   20 o 6.849422 3.211314   6.336261   178.2  -1.082597 1.112669          ?        ? 
1 1 1    9    9   21 o 39.40660 1.526249   46.93001   116.8   15.66759 1.202886          ?        ? 
1 1 1    9    9   22 o 22.69246 2.319107   25.20112   223.1   5.322770 1.052525          ?        ? 
1 1 1    9    9   23 o 24.04095 2.439200   23.95216   158.5   6.074574 1.172814          ?        ? 
1 1 1    9    9   24 o 9.109635 3.791374   4.500603   333.1  0.5713707 1.142741          ?        ? 
1 1 1    9   10    0 o 404.7361 5.083961   475.7389   180.0   1639.984 41.13869   1639.984 41.13869 
1 1 1    9   10    1 o 322.5378 2.685198   407.1827    71.7   1040.677 17.32155          ?        ? 
1 1 1    9   10    2 o 324.2142 2.675952   295.3699    98.7   1051.473 17.35163          ?        ? 
1 1 1    9   10    3 o 383.1931 2.970383   409.2455   278.7   1468.844 22.76461          ?        ? 
1 1 1    9   10    4 o 728.7016 4.844877   918.0305   277.4   5314.350 70.60940          ?        ? 
1 1 1    9   10    5 o 362.8887 2.560646   361.9763   325.3   1317.220 18.58459          ?        ? 
1 1 1    9   10    6 o 313.0502 2.286269   253.5916    25.0   980.2316 14.31434          ?        ? 
1 1 1    9   10    7 o 217.6251 1.526925   165.3509   316.5   473.6664 6.645944          ?        ? 
1 1 1    9   10    8 o 226.1703 1.575605   227.4302   163.1   511.6174 7.127099          ?        ? 
1 1 1    9   10    9 o 259.6502 1.916786   336.7882   106.5   674.4280 9.953879          ?        ? 
1 1 1    9   10   10 o 321.1013 2.294502   349.8917   185.7   1031.775 14.73535          ?        ? 
1 1 1    9   10   11 o 230.3157 1.723514   234.9879   276.2   530.7433 7.939046          ?        ? 
1 1 1    9   10   12 o 154.0119 1.308233   208.5189   236.9   237.2993 4.029667          ?        ? 
1 1 1    9   10   13 o 30.67169 1.274589   15.61386    64.5   9.412581 0.7818757          ?        ? 
1 1 1    9   10   14 f 81.20969 0.9813014   81.79648   238.4   65.97829 1.593824          ?        ? 
1 1 1    9   10   15 f 120.7166 1.195745   148.6388   141.7   145.8499 2.886926          ?        ? 
1 1 1    9   10   16 o 76.69028 0.9803115   76.55548   101.6   58.85118 1.503607          ?        ? 
1 1 1    9   10   17 o 35.12346 1.455513   15.71036   173.4   12.35965 1.022453          ?        ? 
1 1 1    9   10   18 o 64.39875 1.074026   52.24276   109.7   41.52963 1.383319          ?        ? 
1 1 1    9   10   19 o 27.34192 1.649782   30.23609   122.2   7.518036 0.9021643          ?        ? 
1 1 1    9   10   20 o 37.14724 1.538124   29.59826   248.8   13.89333 1.142741          ?        ? 
1 1 1    9   10   21 o 13.86019 3.795428   14.81832   235.0   2.105050 1.082597          ?        ? 
1 1 1    9   10   22 o 12.92324 4.008103   10.16945   351.5   1.864473 1.142741          ?        ? 
1 1 1    9   10   23 o 8.588146 3.690988   13.46721   118.3  0.1804329 1.142741          ?        ? 
1 1 1    9   10   24 o 32.31574 2.093788   32.98792   152.6   11.03648 1.353247          ?        ? 
1 1 1    9   11    0 o 750.7127 7.197928   761.5784     0.0   5643.158 108.0492   5643.158 108.0492 
1 1 1    9   11    1 o 216.8748 1.975924   418.9554   292.1   470.4186 8.570561          ?        ? 
1 1 1    9   11    2 o 430.3703 3.322558   496.3749   199.8   1852.925 28.59861          ?        ? 
1 1 1    9   11    3 o 217.0533 1.738768   295.2339   349.6   471.1704 7.548109          ?        ? 
1 1 1    9   11    4 o 179.5574 1.457070   209.3046    95.2   322.4335 5.232553          ?        ? 
1 1 1    9   11    5 o 269.6274 1.996427   288.6148   251.4   727.1144 10.76583          ?        ? 
1 1 1    9   11    6 o 297.5359 2.198287   359.8072   190.5   885.4743 13.08138          ?        ? 
1 1 1    9   11    7 o 202.8036 1.623689   209.3680   179.7   411.3569 6.585800          ?        ? 
1 1 1    9   11    8 o 168.8237 1.309237   166.8222   138.4   285.0539 4.420605          ?        ? 
1 1 1    9   11    9 o 188.9585 1.503937   179.2107   171.5   357.1368 5.683635          ?        ? 
1 1 1    9   11   10 o 63.23795 0.9510791   58.91673    54.0   39.99595 1.202886          ?        ? 
1 1 1    9   11   11 o 36.20499 1.162851   15.10554   116.8   13.11145 0.8420200          ?        ? 
1 1 1    9   11   12 o 33.16972 1.178599   45.77931    93.3   11.00640 0.7818757          ?        ? 
1 1 1    9   11   13 o 25.88478 1.510300   47.98155   339.1   6.706088 0.7818757          ?        ? 
1 1 1    9   11   14 o 94.89608 0.9982210   119.4465    96.5   90.09615 1.894545          ?        ? 
1 1 1    9   11   15 o 96.05469 1.033141   122.2240    72.8   92.32149 1.984761          ?        ? 
1 1 1    9   11   16 o 118.5808 1.153882   129.6521   225.6   140.7376 2.736565          ?        ? 
1 1 1    9   11   17 o 74.24454 1.073361   56.83678     8.7   55.18238 1.593824          ?        ? 
1 1 1    9   11   18 o 22.54338 2.201047   34.79782   270.1   5.112265 0.9923807          ?        ? 
1 1 1    9   11   19 o 26.04673 1.674092   26.77688   337.5   6.826377 0.8720922          ?        ? 
1 1 1    9   11   20 o 40.30719 1.305629   40.61161   236.7   16.32917 1.052525          ?        ? 
1 1 1    9   11   21 o 7.962066 3.482655   7.790627    51.1 -0.1202886 1.052525          ?        ? 
1 1 1    9   11   22 o 43.18487 1.601624   36.05718   358.7   18.94545 1.383319          ?        ? 
1 1 1    9   11   23 o 7.277275 3.390645   8.424411    84.2 -0.8119479 1.202886          ?        ? 
1 1 1    9   12    0 o 400.8517 4.183423   542.9627    -0.0   1607.837 33.53044   1607.837 33.53044 
1 1 1    9   12    1 o 443.7063 3.595458   495.2183     9.8   1969.635 31.90655          ?        ? 
1 1 1    9   12    2 f 282.6210 2.340899   372.6267   229.0   798.8966 13.23174          ?        ? 
1 1 1    9   12    3 o 204.7353 1.630402   262.2183   285.3   419.2057 6.676016          ?        ? 
1 1 1    9   12    4 o 196.2307 1.570802   205.5886    64.8   385.1039 6.164790          ?        ? 
1 1 1    9   12    5 o 54.45185 0.9112462   148.4958     9.6   29.65113 0.9923807          ?        ? 
1 1 1    9   12    6 o 66.30505 0.9070847   113.7916   331.2   43.96547 1.202886          ?        ? 
1 1 1    9   12    7 o 208.9647 1.640576   313.3018   171.4   436.7378 6.856449          ?        ? 
1 1 1    9   12    8 o 197.6763 1.559315   222.5121   176.0   390.8477 6.164790          ?        ? 
1 1 1    9   12    9 o 127.6699 1.177730   108.0893   203.3   163.0211 3.007215          ?        ? 
1 1 1    9   12   10 o 76.64978 0.9415963   119.5934    84.2   58.76097 1.443463          ?        ? 
1 1 1    9   12   11 o 85.68583 0.9651351   58.70374    34.1   73.43618 1.653968          ?        ? 
1 1 1    9   12   12 o 143.0600 1.250729   139.6262   338.7   204.7612 3.578585          ?        ? 
1 1 1    9   12   13 o 102.4795 1.071076   130.2069    72.5   105.0721 2.195267          ?        ? 
1 1 1    9   12   14 o 67.12419 1.008017   91.27128   119.0   45.07814 1.353247          ?        ? 
1 1 1    9   12   15 o 70.39729 1.067944   76.41219   224.7   49.58897 1.503607          ?        ? 
1 1 1    9   12   16 f 96.40334 1.107390   132.7849   207.6   93.01314 2.135122          ?        ? 
1 1 1    9   12   17 o 81.50973 1.125265   94.12550   295.9   66.51958 1.834401          ?        ? 
1 1 1    9   12   18 o 30.61970 1.669600   27.59628   244.0   9.412581 1.022453          ?        ? 
1 1 1    9   12   19 o 18.55494 2.431063   28.48194   305.1   3.488369 0.9021643          ?        ? 
1 1 1    9   12   20 o 56.85206 1.110804   58.02866    95.1   32.44785 1.263030          ?        ? 
1 1 1    9   12   21 o 25.41883 1.952058   26.50472   352.5   6.585800 0.9923807          ?        ? 
1 1 1    9   12   22 o 31.80920 1.748974   31.76821   148.9   10.31474 1.112669          ?        ? 
1 1 1    9   12   23 o 11.08966 4.099562   11.49422    69.3   1.293102 1.202886          ?        ? 
1 1 1    9   13    0 o 260.7335 2.901525   380.8569     0.0   680.1718 15.12629   680.1718 15.12629 
1 1 1    9   13    1 o 758.7797 5.128413   891.1102    67.0   5762.815 77.82671          ?        ? 
1 1 1    9   13    2 o 267.4467 2.288188   378.6287    22.9   715.4163 12.23936          ?        ? 
1 1 1    9   13    3 o 194.5069 1.569262   221.6137   252.7   378.3677 6.104645          ?        ? 
1 1 1    9   13    4 o 65.04613 0.9015245   146.5981   306.1   42.31151 1.172814          ?        ? 
1 1 1    9   13    5 o 236.4660 1.837653   372.5469   200.3   559.2516 8.690849          ?        ? 
1 1 1    9   13    6 o 129.4054 1.196793   180.4357   347.5   167.4718 3.097431          ?        ? 
1 1 1    9   13    7 o 180.5004 1.532760   221.3355   177.7   325.8618 5.533275          ?        ? 
1 1 1    9   13    8 o 256.9192 1.943015   272.3703   194.5   660.3242 9.983953          ?        ? 
1 1 1    9   13    9 o 54.77995 0.9606847   79.42499   288.0   30.01200 1.052525          ?        ? 
1 1 1    9   13   10 o 94.51318 1.018174   99.21623   253.6   89.34435 1.924617          ?        ? 
1 1 1    9   13   11 o 201.6051 1.648258   224.4539   218.6   406.7258 6.645944          ?        ? 
1 1 1    9   13   12 o 62.53923 0.9857477   73.24120   100.0   39.12386 1.232958          ?        ? 
1 1 1    9   13   13 o 82.38602 1.022042   105.5258   171.8   67.90290 1.684040          ?        ? 
1 1 1    9   13   14 o 33.07082 1.318522   49.75811   121.6   10.94626 0.8720922          ?        ? 
1 1 1    9   13   15 o 107.6057 1.089918   117.0022   317.9   115.8680 2.345627          ?        ? 
1 1 1    9   13   16 o 61.43067 1.101442   92.03183   240.7   37.77061 1.353247          ?        ? 
1 1 1    9   13   17 o 80.77306 1.061067   91.33533   285.9   65.31670 1.714112          ?        ? 
1 1 1    9   13   18 o 22.52114 2.269985   36.00769   132.3   5.112265 1.022453          ?        ? 
1 1 1    9   13   19 f 52.46573 1.117695   59.36305   112.2   27.60623 1.172814          ?        ? 
1 1 1    9   13   20 o 19.65880 2.371041   17.91461   134.6   3.939451 0.9322364          ?        ? 
1 1 1    9   13   21 o 9.324744 3.568969   11.01878   333.3  0.6916593 0.9322364          ?        ? 
1 1 1    9   13   22 f 22.33179 2.154572   19.35184    28.1   5.142337 0.9623086          ?        ? 
1 1 1    9   13   23 o 23.03040 2.611517   14.61022    40.4   5.683635 1.202886          ?        ? 
1 1 1    9   14    0 o 11.70798 4.315555   6.191047   360.0   1.834401 0.9322364   1.834401 0.9322364 
1 1 1    9   14    1 f 593.7018 4.161057   451.2361   163.7   3527.282 49.40854          ?        ? 
1 1 1    9   14    2 o 241.1965 1.776676   245.4854   126.6   581.8359 8.570561          ?        ? 
1 1 1    9   14    3 o 55.86913 0.9688689   111.8230   301.4   31.21489 1.082597          ?        ? 
1 1 1    9   14    4 o 351.0526 2.539901   361.8781     3.3   1232.747 17.83278          ?        ? 
1 1 1    9   14    5 o 363.3391 2.602992   373.6195    65.7   1320.648 18.91538          ?        ? 
1 1 1    9   14    6 o 392.8724 2.782385   454.1879   358.6   1544.265 21.86245          ?        ? 
1 1 1    9   14    7 o 300.1584 2.209136   314.1342    44.2   901.3524 13.26182          ?        ? 
1 1 1    9   14    8 o 56.32270 1.041156   69.55971    29.4   31.72611 1.172814          ?        ? 
1 1 1    9   14    9 o 141.0441 1.300587   239.3187   303.2   198.9874 3.668802          ?        ? 
1 1 1    9   14   10 o 75.02226 1.042192   104.3170    70.4   56.29506 1.563751          ?        ? 
1 1 1    9   14   11 o 99.49876 1.042716   94.93969    62.3   99.02757 2.074978          ?        ? 
1 1 1    9   14   12 o 71.57253 0.9873835   68.61679   262.6   51.24293 1.413391          ?        ? 
1 1 1    9   14   13 o 104.6278 1.063455   114.3642   338.1   109.5228 2.225339          ?        ? 
1 1 1    9   14   14 o 81.60860 1.013354   108.3304   217.2   66.63988 1.653968          ?        ? 
1 1 1    9   14   15 o 58.06644 1.061679   62.10747   123.7   33.74094 1.232958          ?        ? 
1 1 1    9   14   16 o 32.41238 1.530867   52.83819    43.3   10.52525 0.9923807          ?        ? 
1 1 1    9   14   17 o 90.47580 1.113465   107.3441    50.2   81.97667 2.014834          ?        ? 
1 1 1    9   14   18 o 32.60030 1.706533   33.85772   154.5   10.67561 1.112669          ?        ? 
1 1 1    9   14   19 o 48.08252 1.282127   48.97326    96.2   23.21569 1.232958          ?        ? 
1 1 1    9   14   20 o 25.21102 1.848867   34.02424   193.4   6.435439 0.9322364          ?        ? 
1 1 1    9   14   21 o 18.64879 2.660710   29.68760   145.5   3.608657 0.9923807          ?        ? 
1 1 1    9   14   22 o 19.10052 2.755227   10.65761     0.0   3.849235 1.052525          ?        ? 
1 1 1    9   14   23 o 10.99332 3.807782   16.79248    61.9   1.383319 1.022453          ?        ? 
1 1 1    9   15    0 o 406.9383 4.142977   596.2578     0.0   1657.125 33.71087   1657.125 33.71087 
1 1 1    9   15    1 o 104.5924 1.178821   105.2036   245.8   109.4025 2.465916          ?        ? 
1 1 1    9   15    2 o 560.3283 3.595809   612.6917   138.3   3141.487 40.29667          ?        ? 
1 1 1    9   15    3 o 258.7661 1.853607   273.7566   203.5   669.7067 9.593014          ?        ? 
1 1 1    9   15    4 o 188.7291 1.577468   162.4069   295.2   356.2346 5.954284          ?        ? 
1 1 1    9   15    5 o 110.4638 1.170612   94.33976   347.4   122.0328 2.586205          ?        ? 
1 1 1    9   15    6 o 393.8259 2.848190   455.0414   185.2   1551.993 22.43382          ?        ? 
1 1 1    9   15    7 o 187.5040 1.563718   174.3075   182.7   351.6637 5.864068          ?        ? 
1 1 1    9   15    8 o 202.2293 1.643171   233.6899   165.5   409.1015 6.645944          ?        ? 
1 1 1    9   15    9 o 206.5373 1.645297   273.6475   243.2   426.7839 6.796305          ?        ? 
1 1 1    9   15   10 o 247.3344 2.139895   297.5546   211.8   612.3892 10.58539          ?        ? 
1 1 1    9   15   11 o 108.2295 1.250350   143.3828   169.6   117.1912 2.706493          ?        ? 
1 1 1    9   15   12 o 111.9531 1.128178   127.9961   142.4   125.4008 2.526060          ?        ? 
1 1 1    9   15   13 o 9.603966 3.497446   16.99375   343.1  0.7518036 0.8720922          ?        ? 
1 1 1    9   15   14 o 97.21938 1.051697   93.65256   158.0   94.57690 2.044906          ?        ? 
1 1 1    9   15   15 o 21.27348 2.261757   8.922871   222.9   4.540894 0.9623086          ?        ? 
1 1 1    9   15   16 o 47.71024 1.260616   65.25867    40.9   22.79469 1.202886          ?        ? 
1 1 1    9   15   17 o 108.7963 1.202374   107.0981   178.3   118.5745 2.616277          ?        ? 
1 1 1    9   15   18 o 92.27347 1.124363   111.9870   304.2   85.34474 2.074978          ?        ? 
1 1 1    9   15   19 o 31.42676 1.674568   38.15142   284.5   9.953879 1.052525          ?        ? 
1 1 1    9   15   20 o 52.42155 1.233369   56.52235    71.0   27.63630 1.293102          ?        ? 
1 1 1    9   15   21 o 10.62768 3.692843   9.532361   218.7   1.142741 0.9623086          ?        ? 
1 1 1    9   15   22 o 7.907182 3.445797   7.057012     2.1   0.000000 1.022453          ?        ? 
1 1 1    9   15   23 o 14.38602 3.566775   15.39654   248.4   2.465916 1.022453          ?        ? 
1 1 1    9   16    0 o 351.9079 3.743862   389.1041   180.0   1239.213 26.34320   1239.213 26.34320 
1 1 1    9   16    1 o 107.3729 1.162299   185.7307   225.8   115.2966 2.495988          ?        ? 
1 1 1    9   16    2 f 576.1359 3.679837   536.5773   258.5   3321.559 42.40173          ?        ? 
1 1 1    9   16    3 o 78.99158 0.9327166   123.3949   341.0   62.39970 1.473535          ?        ? 
1 1 1    9   16    4 o 77.62777 1.026581   17.07867   326.9   60.26458 1.593824          ?        ? 
1 1 1    9   16    5 o 138.8414 1.277902   212.6445     0.8   192.7925 3.548513          ?        ? 
1 1 1    9   16    6 o 73.28264 1.025896   151.1343   241.1   53.70885 1.503607          ?        ? 
1 1 1    9   16    7 o 31.30731 1.392793   30.99646   356.2   9.803518 0.8720922          ?        ? 
1 1 1    9   16    8 o 307.9477 2.285090   306.8502   220.1   949.0769 14.07376          ?        ? 
1 1 1    9   16    9 o 158.0452 1.369985   172.6409   141.8   249.8695 4.330389          ?        ? 
1 1 1    9   16   10 f 142.4157 1.425313   177.4832    93.3   202.9268 4.059740          ?        ? 
1 1 1    9   16   11 o 80.70879 1.136432   122.2741   357.1   65.16634 1.834401          ?        ? 
1 1 1    9   16   12 o 93.27826 1.192850   88.73476    55.9   87.05886 2.225339          ?        ? 
1 1 1    9   16   13 o 60.20796 0.9989425   60.68759   172.7   36.26701 1.202886          ?        ? 
1 1 1    9   16   14 o 46.41908 1.101328   31.72557    58.0   21.56173 1.022453          ?        ? 
1 1 1    9   16   15 o 36.51356 1.482459   34.29164    72.5   13.35203 1.082597          ?        ? 
1 1 1    9   16   16 o 69.39432 1.040044   65.83058   156.3   48.20565 1.443463          ?        ? 
1 1 1    9   16   17 o 50.42202 1.222638   52.35648   210.1   25.47111 1.232958          ?        ? 
1 1 1    9   16   18 o 43.05700 1.361931   68.25620   319.4   18.61466 1.172814          ?        ? 
1 1 1    9   16   19 o 68.01466 1.127463   76.21428     2.9   46.43139 1.533679          ?        ? 
1 1 1    9   16   20 f 40.82213 1.436492   36.14134   335.5   16.81033 1.172814          ?        ? 
1 1 1    9   16   21 o 25.20267 2.088123   20.50343    13.8   6.525656 1.052525          ?        ? 
1 1 1    9   16   22 o 37.63967 1.557949   30.83388   140.2   14.46470 1.172814          ?        ? 
1 1 1    9   16   23 o 8.760971 3.576007   12.41511    22.9  0.5713707 0.9923807          ?        ? 
1 1 1    9   17    0 o 195.5125 2.415673   250.3704     0.0   382.4876 9.442654   382.4876 9.442654 
1 1 1    9   17    1 o 102.9261 1.037212   39.96116    91.8   105.9442 2.135122          ?        ? 
1 1 1    9   17    2 o 117.1493 1.090972   61.75644   129.3   137.2493 2.556132          ?        ? 
1 1 1    9   17    3 o 242.4265 1.761459   402.4048   234.2   587.8202 8.540489          ?        ? 
1 1 1    9   17    4 o 36.78498 1.062765   29.80457   212.6   13.53246 0.7818757          ?        ? 
1 1 1    9   17    5 o 34.63598 1.432587   47.26112   334.5   11.99879 0.9923807          ?        ? 
1 1 1    9   17    6 o 140.8157 1.313374   151.8919   335.5   198.3258 3.698874          ?        ? 
1 1 1    9   17    7 o 122.7694 1.212494   178.8461    74.4   150.7517 2.977142          ?        ? 
1 1 1    9   17    8 o 14.21485 3.150908   34.83955    76.0   2.105050 0.8720922          ?        ? 
1 1 1    9   17    9 o 132.8150 1.301923   126.1635   170.6   176.4633 3.458297          ?        ? 
1 1 1    9   17   10 o 104.7353 1.134144   109.1579     9.1   109.7333 2.375700          ?        ? 
1 1 1    9   17   11 o 65.58418 1.169245   54.06580   342.4   43.03324 1.533679          ?        ? 
1 1 1    9   17   12 o 119.7775 1.267887   131.4575   316.9   143.5644 3.037287          ?        ? 
1 1 1    9   17   13 o 77.83395 1.139771   98.67123    13.9   60.62545 1.774257          ?        ? 
1 1 1    9   17   14 o 66.46458 1.085889   71.89108   234.9   44.20605 1.443463          ?        ? 
1 1 1    9   17   15 o 142.6460 1.317604   147.3466   209.6   203.7388 3.759018          ?        ? 
1 1 1    9   17   16 o 88.87244 1.167391   91.58002   238.0   79.08974 2.074978          ?        ? 
1 1 1    9   17   17 o 19.67179 2.598780   18.96007   242.1   3.909379 1.022453          ?        ? 
1 1 1    9   17   18 o 31.97256 1.645982   36.95686   120.8   10.28467 1.052525          ?        ? 
1 1 1    9   17   19 o 8.777004 3.614009   16.31069   339.9  0.3007214 1.022453          ?        ? 
1 1 1    9   17   20 o 8.120882 3.566220   8.245101   351.9 -0.1503607 1.112669          ?        ? 
1 1 1    9   17   21 o 12.44311 3.844105   13.59423     2.7   1.714112 1.052525          ?        ? 
1 1 1    9   17   22 o 12.57206 3.901608   12.74776   203.4   1.834401 1.082597          ?        ? 
1 1 1    9   17   23 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1    9   18    0 o 190.9654 2.291992   277.0346   180.0   364.8954 8.750995   364.8954 8.750995 
1 1 1    9   18    1 o 239.9817 1.804466   155.3672   204.4   576.0319 8.660777          ?        ? 
1 1 1    9   18    2 o 81.28008 0.9434534   81.66765   283.3   66.06850 1.533679          ?        ? 
1 1 1    9   18    3 o 111.0605 1.096629   203.5874   181.2   123.3559 2.435844          ?        ? 
1 1 1    9   18    4 o 191.4912 1.444786   224.8426     9.6   366.7599 5.533275          ?        ? 
1 1 1    9   18    5 o 249.3907 1.802708   243.4733   311.9   622.1626 8.991571          ?        ? 
1 1 1    9   18    6 o 315.8260 2.385197   324.5410   120.1   998.1246 15.06614          ?        ? 
1 1 1    9   18    7 o 160.3016 1.463259   124.0955   292.9   257.0567 4.691255          ?        ? 
1 1 1    9   18    8 o 61.32839 1.103279   28.76930   172.7   37.62025 1.353247          ?        ? 
1 1 1    9   18    9 o 165.1875 1.501901   124.5004    17.9   273.0250 4.961904          ?        ? 
1 1 1    9   18   10 o 100.0355 1.097244   140.1488   348.2   100.1102 2.195267          ?        ? 
1 1 1    9   18   11 o 90.26448 1.182703   76.00837   311.7   81.52559 2.135122          ?        ? 
1 1 1    9   18   12 o 26.44787 1.876107   15.32566   323.8   7.006810 0.9923807          ?        ? 
1 1 1    9   18   13 f 67.69254 1.177252   81.82827   108.9   45.86002 1.593824          ?        ? 
1 1 1    9   18   14 o 74.73792 1.126630   58.33302    15.9   55.90411 1.684040          ?        ? 
1 1 1    9   18   15 o 66.31789 1.110963   74.72646   263.4   44.02562 1.473535          ?        ? 
1 1 1    9   18   16 o 26.17966 2.010196   31.86023   321.3   6.886521 1.052525          ?        ? 
1 1 1    9   18   17 o 57.94873 1.167624   58.08636   142.6   33.65073 1.353247          ?        ? 
1 1 1    9   18   18 o 24.82979 1.998367   20.90075    68.9   6.224934 0.9923807          ?        ? 
1 1 1    9   18   19 o 15.08651 3.544535   17.44872   354.2   2.465916 1.052525          ?        ? 
1 1 1    9   18   20 o 30.05523 1.901069   26.52832   212.0   9.202076 1.142741          ?        ? 
1 1 1    9   18   21 o 34.18790 1.803208   34.10820   150.7   11.93864 1.232958          ?        ? 
1 1 1    9   18   22 o 7.196358 3.248552   9.513685    21.1 -0.3007214 0.9923807          ?        ? 
1 1 1    9   19    0 o 68.89655 1.551262   62.16965   180.0   47.54406 2.135122   47.54406 2.135122 
1 1 1    9   19    1 o 241.0190 1.784223   225.9515   355.4   581.0540 8.600634          ?        ? 
1 1 1    9   19    2 o 326.5971 2.324949   403.5809   320.2   1067.170 15.18643          ?        ? 
1 1 1    9   19    3 o 495.1428 3.224990   552.8118   334.1   2454.127 31.93662          ?        ? 
1 1 1    9   19    4 o 162.4212 1.314559   161.4180   256.2   263.8530 4.270245          ?        ? 
1 1 1    9   19    5 o 94.67601 0.9687780   72.38238    60.3   89.64507 1.834401          ?        ? 
1 1 1    9   19    6 o 122.4617 1.166427   81.61687    15.8   149.9998 2.856854          ?        ? 
1 1 1    9   19    7 o 72.32896 1.060211   72.28633   232.0   52.32553 1.533679          ?        ? 
1 1 1    9   19    8 o 156.3337 1.423455   145.1879     4.7   244.5166 4.450677          ?        ? 
1 1 1    9   19    9 o 122.0187 1.232276   106.7376    41.5   148.9473 3.007215          ?        ? 
1 1 1    9   19   10 o 68.15099 1.014893   83.50906   127.8   46.46146 1.383319          ?        ? 
1 1 1    9   19   11 o 107.0898 1.263655   132.4394   192.2   114.7553 2.706493          ?        ? 
1 1 1    9   19   12 o 53.03321 1.275848   55.77652    72.5   28.14753 1.353247          ?        ? 
1 1 1    9   19   13 o 18.31066 2.874078   26.17478    23.7   3.368080 1.052525          ?        ? 
1 1 1    9   19   14 o 65.10601 1.247117   54.10107   246.3   42.43180 1.623896          ?        ? 
1 1 1    9   19   15 o 108.2517 1.194533   125.6072   178.6   117.3415 2.586205          ?        ? 
1 1 1    9   19   16 o 34.54214 1.610597   43.68570   147.6   11.96871 1.112669          ?        ? 
1 1 1    9   19   17 o 10.84828 3.802940   14.53612   103.6   1.082597 1.022453          ?        ? 
1 1 1    9   19   18 o 17.74650 2.795991   41.09603   272.3   3.217719 0.9923807          ?        ? 
1 1 1    9   19   19 o 29.77344 1.969564   30.04420   328.5   8.991571 1.172814          ?        ? 
1 1 1    9   19   20 o 26.65978 2.086794   29.52262     1.1   7.277459 1.112669          ?        ? 
1 1 1    9   19   21 o 37.26623 1.734952   40.83609   341.3   14.19405 1.293102          ?        ? 
1 1 1    9   19   22 o 8.487020 3.669854   6.313565    38.2  0.2105050 1.142741          ?        ? 
1 1 1    9   20    0 o 45.81001 1.447375   111.2281    -0.0   21.05050 1.323174   21.05050 1.323174 
1 1 1    9   20    1 o 119.5968 1.169225   160.2504    79.2   143.0532 2.796710          ?        ? 
1 1 1    9   20    2 o 74.11903 0.9940328   144.8805    55.9   54.94181 1.473535          ?        ? 
1 1 1    9   20    3 o 256.8415 1.926039   278.2767   338.5   659.9332 9.893736          ?        ? 
1 1 1    9   20    4 o 82.52598 1.002089   50.58561   285.0   68.11341 1.653968          ?        ? 
1 1 1    9   20    5 o 49.89547 1.054730   88.62774   231.9   24.89974 1.052525          ?        ? 
1 1 1    9   20    6 o 274.2598 2.012048   264.4104   283.9   752.7359 11.03648          ?        ? 
1 1 1    9   20    7 o 132.9212 1.221699   123.8631   144.0   176.7340 3.247792          ?        ? 
1 1 1    9   20    8 o 60.06289 1.101491   70.69662   158.9   36.08657 1.323174          ?        ? 
1 1 1    9   20    9 o 81.52644 1.051262   97.51057   299.6   66.48952 1.714112          ?        ? 
1 1 1    9   20   10 o 97.11436 1.161214   117.6671   137.4   94.36639 2.255411          ?        ? 
1 1 1    9   20   11 o 57.17903 1.235934   52.79348   231.9   32.71849 1.413391          ?        ? 
1 1 1    9   20   12 o 105.2587 1.299924   102.5763   293.2   110.9061 2.736565          ?        ? 
1 1 1    9   20   13 o 80.91505 1.170700   105.4854   335.2   65.52720 1.894545          ?        ? 
1 1 1    9   20   14 o 78.93371 1.181037   119.6289   163.0   62.36963 1.864473          ?        ? 
1 1 1    9   20   15 f 37.30455 1.652557   10.23917   219.0   13.95348 1.232958          ?        ? 
1 1 1    9   20   16 o 94.10216 1.134470   98.05196   299.5   88.71283 2.135122          ?        ? 
1 1 1    9   20   17 f 34.76207 1.557153   24.69639   328.7   12.14915 1.082597          ?        ? 
1 1 1    9   20   18 o 77.26603 1.225989   80.66579   281.1   59.96386 1.894545          ?        ? 
1 1 1    9   20   19 o 25.63194 2.229136   23.81110   356.4   6.706088 1.142741          ?        ? 
1 1 1    9   20   20 o 43.10534 1.534815   41.63599     7.9   18.85523 1.323174          ?        ? 
1 1 1    9   20   21 o 21.82814 2.686471   30.31656    16.9   5.052120 1.172814          ?        ? 
1 1 1    9   20   22 o 11.46641 4.114217   11.27500    62.0   1.533679 1.202886          ?        ? 
1 1 1    9   21    0 o 52.16807 1.385638   71.90067     0.0   27.27543 1.443463   27.27543 1.443463 
1 1 1    9   21    1 o 62.92890 1.027431   97.07063   277.8   39.60501 1.293102          ?        ? 
1 1 1    9   21    2 o 193.1888 1.502138   239.3855   218.7   373.3156 5.803924          ?        ? 
1 1 1    9   21    3 o 363.5413 2.498145   461.5454   156.3   1322.693 18.16358          ?        ? 
1 1 1    9   21    4 o 162.2933 1.306330   143.0818    60.1   263.4621 4.240172          ?        ? 
1 1 1    9   21    5 o 81.46025 0.9782831   108.0966    41.0   66.36922 1.593824          ?        ? 
1 1 1    9   21    6 o 208.7688 1.656520   248.0071    79.4   436.0762 6.916593          ?        ? 
1 1 1    9   21    7 o 161.7311 1.496810   186.2379    11.0   261.7179 4.841615          ?        ? 
1 1 1    9   21    8 o 185.7011 1.748935   197.3018    41.4   345.1681 6.495584          ?        ? 
1 1 1    9   21    9 o 131.3880 1.327507   172.5448   347.4   172.7344 3.488369          ?        ? 
1 1 1    9   21   10 o 29.25207 2.004668   12.04955    78.8   8.570561 1.172814          ?        ? 
1 1 1    9   21   11 o 111.8953 1.330325   133.2114   336.4   125.3106 2.977142          ?        ? 
1 1 1    9   21   12 o 112.9716 1.304341   116.2738    83.7   127.7465 2.947070          ?        ? 
1 1 1    9   21   13 o 72.34082 1.247103   93.75802     9.3   52.38567 1.804329          ?        ? 
1 1 1    9   21   14 o 33.75172 1.915609   33.45271   138.3   11.42741 1.293102          ?        ? 
1 1 1    9   21   15 o 29.71626 1.973354   24.36915   247.1   8.871283 1.172814          ?        ? 
1 1 1    9   21   16 o 60.32795 1.221271   53.93403    84.2   36.47751 1.473535          ?        ? 
1 1 1    9   21   17 o 18.65613 2.901452   19.22665   193.1   3.548513 1.082597          ?        ? 
1 1 1    9   21   18 o 33.95722 1.682619   24.13407   343.7   11.63792 1.142741          ?        ? 
1 1 1    9   21   19 o 34.61095 1.824610   35.25165   300.3   12.17922 1.263030          ?        ? 
1 1 1    9   21   20 o 36.10762 1.665695   38.91920   187.2   13.26182 1.202886          ?        ? 
1 1 1    9   21   21 o 19.26089 2.966482   28.25977   149.8   3.999595 1.142741          ?        ? 
1 1 1    9   21   22 o 7.862500 3.575769   9.641359   160.1 -0.3007214 1.232958          ?        ? 
1 1 1    9   22    0 o 112.0607 1.570573   92.43365     0.0   125.6715 3.518441   125.6715 3.518441 
1 1 1    9   22    1 f 108.8405 1.132812   132.4768   254.4   118.4843 2.465916          ?        ? 
1 1 1    9   22    2 f 89.66499 1.089996   29.14348     7.8   80.41291 1.954689          ?        ? 
1 1 1    9   22    3 o 153.4140 1.372137   172.2259   134.2   235.4348 4.210100          ?        ? 
1 1 1    9   22    4 o 55.40578 1.004109   77.68909   298.3   30.70366 1.112669          ?        ? 
1 1 1    9   22    5 o 117.0239 1.104990   99.70353   328.1   136.9786 2.586205          ?        ? 
1 1 1    9   22    6 f 50.04230 1.111729   40.19516     7.6   25.05010 1.112669          ?        ? 
1 1 1    9   22    7 o 181.6120 1.631008   174.3732    24.3   330.0718 5.924213          ?        ? 
1 1 1    9   22    8 o 212.3535 1.805574   234.3107    56.5   451.4130 7.668397          ?        ? 
1 1 1    9   22    9 o 102.5225 1.099959   91.30711   170.9   105.1623 2.255411          ?        ? 
1 1 1    9   22   10 o 124.8405 1.324865   127.4610   191.2   155.9842 3.307936          ?        ? 
1 1 1    9   22   11 o 115.5138 1.353735   127.8093    11.3   133.5805 3.127503          ?        ? 
1 1 1    9   22   12 o 98.32972 1.223319   89.59623   275.6   96.77216 2.405771          ?        ? 
1 1 1    9   22   13 o 9.556932 3.924980   22.45987    61.9  0.3007214 1.202886          ?        ? 
1 1 1    9   22   14 o 146.7331 1.444859   145.2024    54.6   215.7376 4.240172          ?        ? 
1 1 1    9   22   15 f 65.71350 1.327113   61.70502   356.4   43.27382 1.744184          ?        ? 
1 1 1    9   22   16 o 46.55852 1.517865   46.87407   284.7   21.77223 1.413391          ?        ? 
1 1 1    9   22   17 o 28.55883 1.948030   36.02157   224.8   8.239767 1.112669          ?        ? 
1 1 1    9   22   18 o 54.83578 1.288749   57.64229   221.0   30.25258 1.413391          ?        ? 
1 1 1    9   22   19 f 21.68328 2.635075   15.78836    83.2   4.871688 1.142741          ?        ? 
1 1 1    9   22   20 o 21.19353 2.766914   23.11035    81.8   4.721327 1.172814          ?        ? 
1 1 1    9   22   21 o 28.91058 1.924329   30.97820   178.2   8.660777 1.112669          ?        ? 
1 1 1    9   23    0 o 116.7417 1.468816   162.1662   180.0   136.3772 3.428224   136.3772 3.428224 
1 1 1    9   23    1 o 250.3117 1.916214   294.0190   273.9   626.9741 9.593014          ?        ? 
1 1 1    9   23    2 o 103.0487 1.123525   90.12779   165.7   106.2148 2.315555          ?        ? 
1 1 1    9   23    3 o 27.46648 1.697044   9.888088   189.3   7.548109 0.9322364          ?        ? 
1 1 1    9   23    4 o 34.93568 1.291179   65.22246   221.0   12.20929 0.9021643          ?        ? 
1 1 1    9   23    5 o 137.9438 1.220816   155.3119   222.8   190.3567 3.368080          ?        ? 
1 1 1    9   23    6 o 117.0138 1.233583   110.6532   208.2   136.9786 2.886926          ?        ? 
1 1 1    9   23    7 o 213.6810 1.667696   239.7528     7.5   457.0064 7.127099          ?        ? 
1 1 1    9   23    8 o 97.24428 1.035965   136.3398    79.2   94.60697 2.014834          ?        ? 
1 1 1    9   23    9 o 107.1923 1.136203   111.1613    74.1   114.9658 2.435844          ?        ? 
1 1 1    9   23   10 o 25.64058 1.876534   36.37574   357.7   6.585800 0.9623086          ?        ? 
1 1 1    9   23   11 o 149.0430 1.321582   131.5930   203.4   222.3534 3.939451          ?        ? 
1 1 1    9   23   12 o 120.6520 1.408245   106.3506   159.2   145.7597 3.398152          ?        ? 
1 1 1    9   23   13 o 85.54845 1.300631   87.96391   284.1   73.28581 2.225339          ?        ? 
1 1 1    9   23   14 o 122.9512 1.381911   132.6389    94.8   151.4734 3.398152          ?        ? 
1 1 1    9   23   15 o 17.68773 3.691032   16.82886   246.7   3.307936 1.263030          ?        ? 
1 1 1    9   23   16 o 36.75324 1.677346   38.23115   355.1   13.59261 1.232958          ?        ? 
1 1 1    9   23   17 o 21.73916 2.489970   26.03052    67.7   4.811543 1.082597          ?        ? 
1 1 1    9   23   18 o 31.71541 1.848965   30.69867   210.7   10.19446 1.172814          ?        ? 
1 1 1    9   23   19 o 19.98593 2.783632   22.97730   125.7   4.180028 1.112669          ?        ? 
1 1 1    9   23   20 o 51.35830 1.434564   49.27088    15.5   26.79428 1.473535          ?        ? 
1 1 1    9   23   21 o 13.96614 4.063099   14.10240    89.4   2.405771 1.202886          ?        ? 
1 1 1    9   24    0 o 171.9716 1.836573   119.6131   180.0   295.9400 6.315150   295.9400 6.315150 
1 1 1    9   24    1 o 190.0849 1.423834   161.5748    98.3   361.4672 5.412986          ?        ? 
1 1 1    9   24    2 o 81.38418 1.034624   36.50759    96.6   66.24894 1.684040          ?        ? 
1 1 1    9   24    3 o 181.7386 1.472676   201.1354   331.2   330.4628 5.352841          ?        ? 
1 1 1    9   24    4 o 136.7995 1.362923   154.0587   196.3   187.2292 3.728946          ?        ? 
1 1 1    9   24    5 o 218.4611 1.823921   236.3637   273.5   477.6960 7.969118          ?        ? 
1 1 1    9   24    6 o 107.5788 1.104167   102.1707   327.4   115.7778 2.375700          ?        ? 
1 1 1    9   24    7 o 118.1466 1.119942   119.9562   170.4   139.6550 2.646349          ?        ? 
1 1 1    9   24    8 o 79.67816 1.019035   118.5097   197.9   63.51237 1.623896          ?        ? 
1 1 1    9   24    9 o 162.3410 1.407828   181.7661   150.4   263.7928 4.570966          ?        ? 
1 1 1    9   24   10 o 71.39233 1.053059   71.75616   114.6   51.00236 1.503607          ?        ? 
1 1 1    9   24   11 o 88.20797 1.039816   112.8511   216.9   77.85678 1.834401          ?        ? 
1 1 1    9   24   12 o 113.8545 1.214988   117.4320   173.3   129.7613 2.766637          ?        ? 
1 1 1    9   24   13 f 63.25863 1.354845   79.26881   205.6   40.08617 1.714112          ?        ? 
1 1 1    9   24   14 o 57.65649 1.382172   68.64881   189.1   33.31994 1.593824          ?        ? 
1 1 1    9   24   15 o 61.97895 1.334298   71.33086   210.5   38.52242 1.653968          ?        ? 
1 1 1    9   24   16 o 52.97837 1.447458   53.18805    95.1   28.20767 1.533679          ?        ? 
1 1 1    9   24   17 o 52.37721 1.377950   51.22857   184.5   27.60623 1.443463          ?        ? 
1 1 1    9   24   18 o 21.74015 2.489856   19.39648    89.3   4.871688 1.082597          ?        ? 
1 1 1    9   24   19 o 16.16567 3.182778   22.55616   249.6   2.856854 0.9923807          ?        ? 
1 1 1    9   24   20 o 17.84498 3.494992   20.34478   230.1   3.608657 1.202886          ?        ? 
1 1 1    9   24   21 o 15.42558 3.895729   14.95087   326.9   2.916998 1.202886          ?        ? 
1 1 1    9   25    0 o 284.0154 2.711137   259.0764     0.0   807.6176 15.39694   807.6176 15.39694 
1 1 1    9   25    1 o 64.94699 0.9723546   67.21036   182.6   42.19122 1.263030          ?        ? 
1 1 1    9   25    2 o 32.94070 1.369377   62.28729    96.6   10.85604 0.9021643          ?        ? 
1 1 1    9   25    3 o 48.91804 1.106542   96.87535   296.0   23.93743 1.082597          ?        ? 
1 1 1    9   25    4 o 265.2199 2.006927   292.6243   200.4   704.2896 10.64554          ?        ? 
1 1 1    9   25    5 o 192.1729 1.541376   265.7373   279.1   369.5867 5.924213          ?        ? 
1 1 1    9   25    6 o 188.4026 1.508375   219.1864   321.0   355.2723 5.683635          ?        ? 
1 1 1    9   25    7 o 57.13363 1.105330   31.33513    25.2   32.65835 1.263030          ?        ? 
1 1 1    9   25    8 o 117.3225 1.127810   121.3435   209.6   137.7304 2.646349          ?        ? 
1 1 1    9   25    9 o 55.33582 1.141241   64.88214   321.0   30.64352 1.263030          ?        ? 
1 1 1    9   25   10 f 48.19415 1.216759   41.85386   218.9   23.24577 1.172814          ?        ? 
1 1 1    9   25   11 o 119.8786 1.153933   123.6353   321.8   143.8351 2.766637          ?        ? 
1 1 1    9   25   12 o 184.0293 1.552390   175.7844     7.4   339.3341 5.713707          ?        ? 
1 1 1    9   25   13 o 60.49425 1.292479   85.87601   322.7   36.65794 1.563751          ?        ? 
1 1 1    9   25   14 o 69.57529 1.210229   77.56042    20.5   48.50637 1.684040          ?        ? 
1 1 1    9   25   15 o 45.83944 1.672882   53.73922    29.8   21.14072 1.533679          ?        ? 
1 1 1    9   25   16 o 87.71945 1.405570   89.94949    68.3   77.37563 2.465916          ?        ? 
1 1 1    9   25   17 o 11.86612 3.922609   9.321904   184.0   1.443463 1.082597          ?        ? 
1 1 1    9   25   18 o 50.83517 1.390170   50.23376    26.1   26.10262 1.413391          ?        ? 
1 1 1    9   25   19 o 14.45262 3.873651   4.635100   169.8   2.375700 1.142741          ?        ? 
1 1 1    9   25   20 o 13.85161 4.073837   16.61231    63.4   2.285483 1.202886          ?        ? 
1 1 1    9   26    0 o 52.73286 1.428000   55.41843   180.0   27.87688 1.503607   27.87688 1.503607 
1 1 1    9   26    1 o 80.22945 0.9370670   106.9428    99.4   64.38446 1.503607          ?        ? 
1 1 1    9   26    2 o 177.9193 1.504290   189.6196   360.0   316.7800 5.352841          ?        ? 
1 1 1    9   26    3 o 56.42323 1.012652   52.90655   181.3   31.84640 1.142741          ?        ? 
1 1 1    9   26    4 o 112.3036 1.218378   93.87718   295.3   126.1827 2.736565          ?        ? 
1 1 1    9   26    5 o 24.26031 1.859342   32.31678    73.3   5.894140 0.9021643          ?        ? 
1 1 1    9   26    6 o 141.6880 1.262840   129.2283   310.5   200.8819 3.578585          ?        ? 
1 1 1    9   26    7 o 43.64806 1.240144   42.61361   253.4   19.06574 1.082597          ?        ? 
1 1 1    9   26    8 o 98.76848 1.096096   74.69970   154.0   97.61418 2.165194          ?        ? 
1 1 1    9   26    9 o 53.96175 1.142437   64.35312    79.3   29.13991 1.232958          ?        ? 
1 1 1    9   26   10 o 43.70778 1.341653   46.54656   193.3   19.12588 1.172814          ?        ? 
1 1 1    9   26   11 o 72.55373 1.098375   86.18701   247.6   52.68640 1.593824          ?        ? 
1 1 1    9   26   12 f 126.4845 1.331420   113.1992   171.7   160.2545 3.368080          ?        ? 
1 1 1    9   26   13 o 61.80973 1.289298   75.76283   232.7   38.28184 1.593824          ?        ? 
1 1 1    9   26   14 o 25.02463 2.343319   15.79292    99.5   6.315150 1.172814          ?        ? 
1 1 1    9   26   15 o 9.827166 3.902230   12.12703   149.3  0.5713707 1.142741          ?        ? 
1 1 1    9   26   16 o 20.85792 2.739347   34.50571    60.3   4.450677 1.142741          ?        ? 
1 1 1    9   26   17 o 34.45864 1.745405   34.00815   334.2   12.02886 1.202886          ?        ? 
1 1 1    9   26   18 o 8.862587 3.845551   13.43078    42.1       0.03 1.263030          ?        ? 
1 1 1    9   26   19 o 29.76701 1.919476   22.73280   219.4   9.111859 1.142741          ?        ? 
1 1 1    9   26   20 o 8.179933 3.602978   5.477214   316.4       0.03 1.142741          ?        ? 
1 1 1    9   27    0 o 5.600860 3.758258   10.05015     0.0 -0.3608657 1.142741 -0.3608657 1.142741 
1 1 1    9   27    1 o 139.6390 1.173692   155.2524   337.1   195.0780 3.277864          ?        ? 
1 1 1    9   27    2 o 124.8643 1.168067   145.7719   239.8   155.9842 2.916998          ?        ? 
1 1 1    9   27    3 o 20.12994 2.166157   10.48742   172.4   4.059740 0.8720922          ?        ? 
1 1 1    9   27    4 o 136.7469 1.341457   134.6380   153.2   187.1389 3.668802          ?        ? 
1 1 1    9   27    5 o 80.03560 1.014483   64.44726    87.8   64.08374 1.623896          ?        ? 
1 1 1    9   27    6 o 60.45450 1.069484   44.46537    66.9   36.56773 1.293102          ?        ? 
1 1 1    9   27    7 o 262.3891 1.965544   247.4161    85.4   689.8550 10.31474          ?        ? 
1 1 1    9   27    8 o 43.50262 1.382544   64.78715     6.8   18.94545 1.202886          ?        ? 
1 1 1    9   27    9 f 98.21645 1.071638   116.3389   165.7   96.53159 2.105050          ?        ? 
1 1 1    9   27   10 o 101.1645 1.099862   96.01474   125.2   102.4257 2.225339          ?        ? 
1 1 1    9   27   11 o 52.95997 1.277613   44.48130   100.2   28.08738 1.353247          ?        ? 
1 1 1    9   27   12 o 43.94369 1.642401   39.74434     9.9   19.36646 1.443463          ?        ? 
1 1 1    9   27   13 o 52.92771 1.363617   61.06611   233.2   28.08738 1.443463          ?        ? 
1 1 1    9   27   14 o 90.11101 1.234776   98.67287   357.7   81.46544 2.225339          ?        ? 
1 1 1    9   27   15 o 10.80658 4.037370   18.35696   319.8  0.9623086 1.172814          ?        ? 
1 1 1    9   27   16 o 23.57883 2.487005   33.24214   301.8   5.683635 1.172814          ?        ? 
1 1 1    9   27   17 o 33.39354 1.801075   36.44832   191.1   11.33720 1.202886          ?        ? 
1 1 1    9   27   18 o 17.57328 3.198529   21.60769   277.5   3.368080 1.082597          ?        ? 
1 1 1    9   27   19 o 8.999842 3.679681   5.904116    32.4  0.5112265 1.052525          ?        ? 
1 1 1    9   27   20 o 6.152168 2.913858  0.9275464    75.5 -0.9021643 0.9623086          ?        ? 
1 1 1    9   28    0 o 17.49326 4.056154   12.49284   180.0   3.518441 1.232958   3.518441 1.232958 
1 1 1    9   28    1 o 111.2012 1.068199   109.0111   254.0   123.7168 2.375700          ?        ? 
1 1 1    9   28    2 o 169.2593 1.465770   178.0576   160.7   286.7379 4.961904          ?        ? 
1 1 1    9   28    3 o 41.60589 1.264875   52.04480   210.0   17.32155 1.052525          ?        ? 
1 1 1    9   28    4 o 72.73312 1.033647   60.31519   282.1   52.92698 1.503607          ?        ? 
1 1 1    9   28    5 f 186.8484 1.504827   188.0532   263.2   349.4984 5.623491          ?        ? 
1 1 1    9   28    6 o 71.31117 1.033173   66.21363   299.0   50.88207 1.473535          ?        ? 
1 1 1    9   28    7 o 63.52908 1.088729   39.49110   204.1   40.38689 1.383319          ?        ? 
1 1 1    9   28    8 o 91.98736 1.160552   83.23045    69.9   84.68316 2.135122          ?        ? 
1 1 1    9   28    9 o 88.28142 1.175207   117.1888   275.0   78.00714 2.074978          ?        ? 
1 1 1    9   28   10 o 87.40820 1.083734   86.47482   317.4   76.47346 1.894545          ?        ? 
1 1 1    9   28   11 o 33.66843 1.697052   12.50560   290.0   11.36727 1.142741          ?        ? 
1 1 1    9   28   12 o 132.1539 1.388079   136.4314   116.4   175.0499 3.668802          ?        ? 
1 1 1    9   28   13 o 19.78817 2.963421   22.79906    43.5   3.969523 1.172814          ?        ? 
1 1 1    9   28   14 o 54.46752 1.407884   52.20942   266.1   29.80149 1.533679          ?        ? 
1 1 1    9   28   15 f 9.822445 3.866215   7.737087   348.2  0.6315150 1.112669          ?        ? 
1 1 1    9   28   16 o 40.64264 1.627816   43.53055   137.7   16.69004 1.323174          ?        ? 
1 1 1    9   28   17 o 29.64415 2.181041   38.80765   116.3   9.021644 1.293102          ?        ? 
1 1 1    9   28   18 o 45.15361 1.531792   46.64192   204.8   20.71971 1.383319          ?        ? 
1 1 1    9   28   19 o 21.05734 2.713404   19.25841   308.0   4.751399 1.142741          ?        ? 
1 1 1    9   29    0 o 132.9008 1.686359   123.1007   180.0   176.8242 4.480750   176.8242 4.480750 
1 1 1    9   29    1 o 126.0673 1.121140   105.1908   124.0   159.0215 2.826782          ?        ? 
1 1 1    9   29    2 o 115.0849 1.136672   91.34521     6.6   132.5279 2.616277          ?        ? 
1 1 1    9   29    3 o 142.8072 1.284530   135.0117   344.6   204.0997 3.668802          ?        ? 
1 1 1    9   29    4 o 35.39092 1.571970   32.50809   359.1   12.54008 1.112669          ?        ? 
1 1 1    9   29    5 f 85.24369 1.075974   79.37243   118.3   72.71445 1.834401          ?        ? 
1 1 1    9   29    6 o 109.1226 1.212558   119.5494    27.4   119.1759 2.646349          ?        ? 
1 1 1    9   29    7 o 56.43558 1.198930   77.02724   311.3   31.87647 1.353247          ?        ? 
1 1 1    9   29    8 o 61.25586 1.227317   56.89054   266.2   37.56011 1.503607          ?        ? 
1 1 1    9   29    9 o 94.78749 1.205583   91.19049   197.4   89.94579 2.285483          ?        ? 
1 1 1    9   29   10 o 19.38948 2.869261   27.71004     6.7   3.789090 1.112669          ?        ? 
1 1 1    9   29   11 o 66.38847 1.155080   54.36813    87.8   44.14591 1.533679          ?        ? 
1 1 1    9   29   12 o 22.98395 2.943895   47.49308   241.9   5.352841 1.353247          ?        ? 
1 1 1    9   29   13 o 75.45411 1.275356   75.79690   143.2   57.13707 1.924617          ?        ? 
1 1 1    9   29   14 o 31.28724 1.970385   30.15863   254.6   9.893736 1.232958          ?        ? 
1 1 1    9   29   15 o 16.38990 3.669862   22.14018    54.8   2.916998 1.172814          ?        ? 
1 1 1    9   29   16 o 27.59891 2.288188   31.30308   250.4   7.818758 1.263030          ?        ? 
1 1 1    9   29   17 f 15.35989 3.905682   13.37746   168.2   2.676421 1.202886          ?        ? 
1 1 1    9   29   18 o 45.19131 1.563786   33.45385   134.8   20.84000 1.413391          ?        ? 
1 1 1    9   29   19 o 8.356819 3.722146   4.847991   346.5      -0.06 1.263030          ?        ? 
1 1 1    9   30    0 o 48.28000 1.560757   53.38334   180.0   23.39613 1.503607   23.39613 1.503607 
1 1 1    9   30    1 o 77.74873 0.9476266   85.62938   216.7   60.47509 1.473535          ?        ? 
1 1 1    9   30    2 o 139.6771 1.259491   127.3653   131.0   195.2584 3.518441          ?        ? 
1 1 1    9   30    3 o 303.6346 2.154133   282.3096   101.3   924.4478 13.08138          ?        ? 
1 1 1    9   30    4 o 226.3890 1.760050   221.2522    58.1   513.4518 7.969118          ?        ? 
1 1 1    9   30    5 o 133.4471 1.261954   139.4173   325.8   178.2376 3.368080          ?        ? 
1 1 1    9   30    6 o 31.89933 1.744032   37.52686   344.7   10.19446 1.112669          ?        ? 
1 1 1    9   30    7 o 83.80029 1.076565   66.73437   222.0   70.27860 1.804329          ?        ? 
1 1 1    9   30    8 o 108.0554 1.224533   118.3406    57.2   116.8904 2.646349          ?        ? 
1 1 1    9   30    9 o 151.4928 1.369687   156.6733   208.8   229.9016 4.149956          ?        ? 
1 1 1    9   30   10 o 57.75364 1.223638   66.56262   295.4   33.41015 1.413391          ?        ? 
1 1 1    9   30   11 o 44.85861 1.441309   45.14661   224.1   20.17841 1.293102          ?        ? 
1 1 1    9   30   12 o 46.46249 1.553364   36.97770    30.8   21.68202 1.443463          ?        ? 
1 1 1    9   30   13 o 22.63020 2.591258   33.85031   157.8   5.202481 1.172814          ?        ? 
1 1 1    9   30   14 o 51.64791 1.484745   45.81684    78.4   26.85443 1.533679          ?        ? 
1 1 1    9   30   15 o 63.94647 1.316758   59.68456    65.8   41.16877 1.684040          ?        ? 
1 1 1    9   30   16 o 52.29502 1.466372   44.48732   114.6   27.66637 1.533679          ?        ? 
1 1 1    9   30   17 o 7.984964 3.548956   17.48228    26.3 -0.2405772 1.142741          ?        ? 
1 1 1    9   30   18 o 25.39633 2.427433   23.20733    27.2   6.796305 1.232958          ?        ? 
1 1 1    9   30   19 o 29.33300 2.152917   27.44410    64.1   9.111859 1.263030          ?        ? 
1 1 1    9   31    0 o 30.51119 2.241786   1.042700   360.0   9.472726 1.353247   9.472726 1.353247 
1 1 1    9   31    1 o 79.46278 1.021796   38.14264   351.1   63.18158 1.623896          ?        ? 
1 1 1    9   31    2 o 113.9412 1.082100   122.3567    28.8   129.9117 2.465916          ?        ? 
1 1 1    9   31    3 o 68.81953 1.114276   81.30594   243.4   47.39370 1.533679          ?        ? 
1 1 1    9   31    4 o 44.93070 1.338601   53.70777   344.3   20.20848 1.202886          ?        ? 
1 1 1    9   31    5 o 36.87711 1.630938   19.90311   301.2   13.62268 1.202886          ?        ? 
1 1 1    9   31    6 o 88.81327 1.083519   71.59359    16.9   78.93938 1.924617          ?        ? 
1 1 1    9   31    7 o 41.87114 1.508235   46.39240    38.1   17.56213 1.263030          ?        ? 
1 1 1    9   31    8 o 40.55387 1.483071   45.83004   105.7   16.47953 1.202886          ?        ? 
1 1 1    9   31    9 o 99.21345 1.182112   106.6360   192.5   98.57648 2.345627          ?        ? 
1 1 1    9   31   10 f 44.62883 1.448730   45.70406   211.2   19.96791 1.293102          ?        ? 
1 1 1    9   31   11 o 81.42184 1.144946   85.83829   100.1   66.42937 1.864473          ?        ? 
1 1 1    9   31   12 o 12.28692 3.787362   16.51718   322.5   1.563751 1.022453          ?        ? 
1 1 1    9   31   13 o 52.06045 1.357452   44.99068    85.0   27.24536 1.413391          ?        ? 
1 1 1    9   31   14 o 28.95007 2.285270   24.82764   320.1   8.540489 1.323174          ?        ? 
1 1 1    9   31   15 o 41.14353 1.681089   44.94841   352.4   17.17119 1.383319          ?        ? 
1 1 1    9   31   16 o 11.85395 4.219543   18.24272    46.3   1.443463 1.263030          ?        ? 
1 1 1    9   31   17 o 22.92606 2.820158   18.56229   165.1   5.593419 1.293102          ?        ? 
1 1 1    9   31   18 o 14.17053 4.044024   18.54642   254.7   2.465916 1.202886          ?        ? 
1 1 1    9   32    0 o 115.0650 1.660341   134.9924     0.0   132.5881 3.819162   132.5881 3.819162 
1 1 1    9   32    1 o 87.37012 1.032578   84.55109   101.4   76.38325 1.804329          ?        ? 
1 1 1    9   32    2 o 53.51309 1.123917   55.95829     3.6   28.65875 1.202886          ?        ? 
1 1 1    9   32    3 o 92.36050 1.123304   76.84111   274.8   85.37482 2.074978          ?        ? 
1 1 1    9   32    4 o 74.41629 1.111294   48.03832   163.9   55.42296 1.653968          ?        ? 
1 1 1    9   32    5 o 17.23250 3.437409   26.89372   241.7   3.097431 1.142741          ?        ? 
1 1 1    9   32    6 o 162.3733 1.351987   155.8523   331.4   264.0334 4.390533          ?        ? 
1 1 1    9   32    7 o 56.92183 1.241519   57.49560   307.0   32.44785 1.413391          ?        ? 
1 1 1    9   32    8 o 49.15128 1.407205   35.58645   143.2   24.20808 1.383319          ?        ? 
1 1 1    9   32    9 o 38.83107 1.626314   45.21452    72.5   15.12629 1.263030          ?        ? 
1 1 1    9   32   10 o 49.31371 1.372079   46.47903   348.8   24.38851 1.353247          ?        ? 
1 1 1    9   32   11 o 17.43892 3.397633   24.63492   233.1   3.217719 1.142741          ?        ? 
1 1 1    9   32   12 o 5.264222 2.618776   2.640558    34.1  -2.676421 1.082597          ?        ? 
1 1 1    9   32   13 o 10.68647 4.028365   14.20189   341.7  0.9322364 1.172814          ?        ? 
1 1 1    9   32   14 o 12.89703 4.129531   4.521412   313.1   1.774257 1.202886          ?        ? 
1 1 1    9   32   15 f 39.81503 1.737181   19.37366   180.1   16.11867 1.383319          ?        ? 
1 1 1    9   32   16 o 41.12972 1.827884   41.18384    81.6   17.29148 1.503607          ?        ? 
1 1 1    9   32   17 o 17.86086 3.896208   21.04489   196.5   3.728946 1.353247          ?        ? 
1 1 1    9   32   18 o 8.617717 3.721986   8.908574   319.4  0.2706493 1.172814          ?        ? 
1 1 1    9   33    0 o 203.4769 2.173090   214.8242     0.0   414.8152 8.841210   414.8152 8.841210 
1 1 1    9   33    1 o 47.81560 1.194946   28.54312   329.5   22.88490 1.142741          ?        ? 
1 1 1    9   33    2 o 81.78609 1.066309   86.26149   350.9   66.94060 1.744184          ?        ? 
1 1 1    9   33    3 o 47.58679 1.358678   47.23607    74.5   22.67440 1.293102          ?        ? 
1 1 1    9   33    4 o 30.68815 1.861861   40.92975   191.8   9.442654 1.142741          ?        ? 
1 1 1    9   33    5 o 105.8890 1.178587   88.22181   241.2   112.2593 2.495988          ?        ? 
1 1 1    9   33    6 o 66.46258 1.221662   52.06763   118.5   44.23613 1.623896          ?        ? 
1 1 1    9   33    7 o 34.53609 1.785028   41.00550    40.2   11.96871 1.232958          ?        ? 
1 1 1    9   33    8 o 47.25030 1.336531   60.17761    69.0   22.37368 1.263030          ?        ? 
1 1 1    9   33    9 o 67.91134 1.195600   88.23615    95.8   46.22089 1.623896          ?        ? 
1 1 1    9   33   10 o 51.61073 1.311013   58.82669   224.8   26.73414 1.353247          ?        ? 
1 1 1    9   33   11 o 48.94033 1.351824   40.81159     6.6   24.05772 1.323174          ?        ? 
1 1 1    9   33   12 o 43.46453 1.418350   38.69425   147.9   19.00560 1.232958          ?        ? 
1 1 1    9   33   13 o 23.28641 2.647376   24.31907   162.1   5.563347 1.232958          ?        ? 
1 1 1    9   33   14 o 28.41440 2.328352   25.56552    76.9   8.299912 1.323174          ?        ? 
1 1 1    9   33   15 o 26.24111 2.521186   22.29578     1.2   7.157170 1.323174          ?        ? 
1 1 1    9   33   16 o 18.38005 3.563031   23.63573   115.3   3.819162 1.263030          ?        ? 
1 1 1    9   33   17 o 26.11956 2.360219   25.95966   292.6   7.247387 1.232958          ?        ? 
1 1 1    9   34    0 o 65.22068 1.500284   50.88928    -0.0   42.64230 1.954689   42.64230 1.954689 
1 1 1    9   34    1 o 36.46738 1.484336   19.12537    46.0   13.32196 1.082597          ?        ? 
1 1 1    9   34    2 o 65.86438 1.095784   42.28043   218.6   43.42418 1.443463          ?        ? 
1 1 1    9   34    3 o 90.43539 1.180468   70.47202    98.0   81.88644 2.135122          ?        ? 
1 1 1    9   34    4 o 54.02270 1.280312   56.15062   227.6   29.23012 1.383319          ?        ? 
1 1 1    9   34    5 o 21.79314 2.621792   28.55279   218.2   4.781471 1.142741          ?        ? 
1 1 1    9   34    6 o 31.95844 1.834904   19.21319   285.2   10.25460 1.172814          ?        ? 
1 1 1    9   34    7 o 43.01569 1.503059   41.30246    96.7   18.55451 1.293102          ?        ? 
1 1 1    9   34    8 o 99.86456 1.144291   82.82462    42.3   99.92973 2.285483          ?        ? 
1 1 1    9   34    9 o 81.72479 1.232694   89.82962    87.3   67.00074 2.014834          ?        ? 
1 1 1    9   34   10 o 63.69843 1.227465   58.43700   293.9   40.71768 1.563751          ?        ? 
1 1 1    9   34   11 o 9.386216 3.835312   26.65037    95.0  0.3909379 1.142741          ?        ? 
1 1 1    9   34   12 o 33.48451 1.751278   24.68910   211.8   11.33720 1.172814          ?        ? 
1 1 1    9   34   13 o 39.60294 1.708518   43.15676   229.5   15.90816 1.353247          ?        ? 
1 1 1    9   34   14 o 38.16201 1.812429   32.23370   195.1   14.85564 1.383319          ?        ? 
1 1 1    9   34   15 o 9.592389 4.015263   10.76970   199.6  0.4210100 1.293102          ?        ? 
1 1 1    9   34   16 o 15.99149 3.887404   9.582585    63.7   3.007215 1.232958          ?        ? 
1 1 1    9   34   17 o 12.92154 4.385616   11.98583   211.6   2.105050 1.353247          ?        ? 
1 1 1    9   35    0 o 59.06223 1.606484   74.27724   180.0   35.00398 1.894545   35.00398 1.894545 
1 1 1    9   35    1 o 23.72103 2.218548   13.77386    41.3   5.653563 1.052525          ?        ? 
1 1 1    9   35    2 o 86.28007 1.028196   93.20473   194.3   74.51878 1.774257          ?        ? 
1 1 1    9   35    3 o 149.4677 1.317827   117.0007   187.9   223.7969 3.939451          ?        ? 
1 1 1    9   35    4 o 32.60916 1.844399   30.57139   138.9   10.67561 1.202886          ?        ? 
1 1 1    9   35    5 o 47.30592 1.430314   47.60402   276.1   22.43382 1.353247          ?        ? 
1 1 1    9   35    6 o 7.351490 3.359097   8.572483    75.1 -0.7518036 1.112669          ?        ? 
1 1 1    9   35    7 o 35.58828 1.690003   32.30593   323.5   12.72052 1.202886          ?        ? 
1 1 1    9   35    8 o 9.109696 3.729451   13.63746   296.3  0.3307936 1.082597          ?        ? 
1 1 1    9   35    9 o 100.8841 1.266866   84.98721   201.3   102.1551 2.556132          ?        ? 
1 1 1    9   35   10 o 25.51903 2.356841   19.87121    76.1   6.615872 1.202886          ?        ? 
1 1 1    9   35   11 o 34.96722 1.763019   38.21724   153.8   12.35965 1.232958          ?        ? 
1 1 1    9   35   12 o 52.84945 1.337186   55.16255   165.8   28.14753 1.413391          ?        ? 
1 1 1    9   35   13 f 47.72806 1.606685   51.40372   275.9   23.09541 1.533679          ?        ? 
1 1 1    9   35   14 o 33.31059 2.076395   32.91861     7.4   11.39734 1.383319          ?        ? 
1 1 1    9   35   15 o 11.89849 4.396745   10.39215    11.2   1.503607 1.383319          ?        ? 
1 1 1    9   35   16 f 16.12605 4.019099   13.67849    73.5   3.187647 1.293102          ?        ? 
1 1 1    9   36    0 o 50.60248 1.727831   63.52539   180.0   25.74175 1.744184   25.74175 1.744184 
1 1 1    9   36    1 o 35.78119 1.554824   20.25379   279.8   12.84081 1.112669          ?        ? 
1 1 1    9   36    2 o 75.55762 1.054707   55.31400   131.8   57.16715 1.593824          ?        ? 
1 1 1    9   36    3 o 39.17207 1.688926   49.11937    16.3   15.39694 1.323174          ?        ? 
1 1 1    9   36    4 o 64.96169 1.203595   44.58797   303.4   42.28144 1.563751          ?        ? 
1 1 1    9   36    5 o 34.12493 1.718412   20.87881   306.5   11.69806 1.172814          ?        ? 
1 1 1    9   36    6 o 51.12722 1.382229   53.81020   346.1   26.22291 1.413391          ?        ? 
1 1 1    9   36    7 o 47.62809 1.483779   45.20491   277.7   22.79469 1.413391          ?        ? 
1 1 1    9   36    8 o 41.75859 1.512300   46.19295    77.5   17.53206 1.263030          ?        ? 
1 1 1    9   36    9 o 25.56777 2.411156   33.74929   285.3   6.645944 1.232958          ?        ? 
1 1 1    9   36   10 o 12.22877 4.030099   4.658120   166.0   1.533679 1.142741          ?        ? 
1 1 1    9   36   11 o 29.42747 2.094910   28.83883    55.0   8.811138 1.232958          ?        ? 
1 1 1    9   36   12 o 27.09173 2.164523   38.86033   160.7   7.518036 1.172814          ?        ? 
1 1 1    9   36   13 o 7.769375 3.579525   6.590815   325.3 -0.7818757 1.293102          ?        ? 
1 1 1    9   36   14 o 51.76300 1.626683   47.61478   257.9   27.33558 1.684040          ?        ? 
1 1 1    9   36   15 o 40.33635 1.901113   32.72415     4.1   16.84040 1.533679          ?        ? 
1 1 1    9   36   16 o 9.375252 3.998496   15.12781    58.1  0.5112265 1.323174          ?        ? 
1 1 1    9   37    0 o 23.80289 3.192933   29.35973   180.0   5.833996 1.503607   5.833996 1.503607 
1 1 1    9   37    1 o 43.70939 1.341604   37.17804    46.0   19.15596 1.172814          ?        ? 
1 1 1    9   37    2 o 25.21984 2.146320   11.38258   258.2   6.405366 1.082597          ?        ? 
1 1 1    9   37    3 o 10.99238 4.003490   21.97456   310.4   1.022453 1.142741          ?        ? 
1 1 1    9   37    4 o 17.97052 3.470694   11.16744    99.3   3.398152 1.202886          ?        ? 
1 1 1    9   37    5 o 33.05523 1.864997   33.52435   218.0   11.00640 1.232958          ?        ? 
1 1 1    9   37    6 o 30.06466 1.900473   38.68659    26.9   9.111859 1.142741          ?        ? 
1 1 1    9   37    7 o 10.01470 3.924769   12.24820   162.3  0.6615872 1.142741          ?        ? 
1 1 1    9   37    8 o 43.65045 1.550095   39.21273   359.9   19.18603 1.353247          ?        ? 
1 1 1    9   37    9 o 14.30727 3.964520   19.28830   160.9   2.225339 1.172814          ?        ? 
1 1 1    9   37   10 o 34.06414 1.853900   34.91331   186.6   11.75821 1.263030          ?        ? 
1 1 1    9   37   11 o 11.48908 4.115026   17.14702   261.0   1.293102 1.202886          ?        ? 
1 1 1    9   37   12 o 21.99088 2.666592   22.40539   272.7   5.052120 1.172814          ?        ? 
1 1 1    9   37   13 o 31.30967 2.305139   25.52400    11.8   10.16438 1.443463          ?        ? 
1 1 1    9   37   14 o 29.36777 2.355164   20.35033   272.8   9.051716 1.383319          ?        ? 
1 1 1    9   37   15 o 9.032189 3.971326   9.581418   329.8  0.1804329 1.383319          ?        ? 
1 1 1    9   38    0 o 35.18224 2.328649   7.973456   360.0   12.60023 1.623896   12.60023 1.623896 
1 1 1    9   38    1 f 62.66901 1.103670   48.18412   228.6   39.36444 1.383319          ?        ? 
1 1 1    9   38    2 o 23.96601 2.258610   27.24134   130.0   5.803924 1.082597          ?        ? 
1 1 1    9   38    3 o 98.78365 1.187255   87.20260   275.8   97.88483 2.345627          ?        ? 
1 1 1    9   38    4 o 39.66480 1.554222   35.72016   238.9   15.81795 1.232958          ?        ? 
1 1 1    9   38    5 o 52.30914 1.379743   50.03721   254.7   27.48594 1.443463          ?        ? 
1 1 1    9   38    6 o 32.81896 1.970054   33.79571   187.6   10.88612 1.293102          ?        ? 
1 1 1    9   38    7 f 39.99989 1.578792   35.54702   197.2   16.11867 1.263030          ?        ? 
1 1 1    9   38    8 o 47.44759 1.426044   47.96236   292.8   22.67440 1.353247          ?        ? 
1 1 1    9   38    9 o 20.84599 2.813045   24.23589   184.8   4.480750 1.172814          ?        ? 
1 1 1    9   38   10 o 11.85976 3.976717   8.816147   347.7   1.473535 1.112669          ?        ? 
1 1 1    9   38   11 o 46.15074 1.563857   39.81732   211.4   21.62187 1.443463          ?        ? 
1 1 1    9   38   12 o 13.34199 4.107036   7.288156    68.9   2.014834 1.202886          ?        ? 
1 1 1    9   38   13 o 30.50333 2.168902   36.90997   278.7   9.683230 1.323174          ?        ? 
1 1 1    9   38   14 o 8.287315 3.848599   11.46612   127.1 -0.7217315 1.533679          ?        ? 
1 1 1    9   39    0 o 54.88797 1.702037   38.19318   180.0   30.31272 1.864473   30.31272 1.864473 
1 1 1    9   39    1 o 58.71793 1.152328   47.16386   226.9   34.58297 1.353247          ?        ? 
1 1 1    9   39    2 o 60.52315 1.167645   36.38929   181.0   36.74816 1.413391          ?        ? 
1 1 1    9   39    3 f 90.27462 1.149259   76.24100   151.4   81.76616 2.074978          ?        ? 
1 1 1    9   39    4 o 61.01078 1.232247   41.57341   142.7   37.37968 1.503607          ?        ? 
1 1 1    9   39    5 o 67.97228 1.216649   61.08732    64.3   46.40132 1.653968          ?        ? 
1 1 1    9   39    6 o 21.76371 2.625338   21.47766   223.8   4.841615 1.142741          ?        ? 
1 1 1    9   39    7 o 71.05815 1.206133   56.58580   202.5   50.76178 1.714112          ?        ? 
1 1 1    9   39    8 f 29.61687 2.081513   21.78328   212.5   8.931427 1.232958          ?        ? 
1 1 1    9   39    9 o 29.69128 2.126938   18.48569    25.7   9.021644 1.263030          ?        ? 
1 1 1    9   39   10 o 33.61810 1.878497   29.40388    36.3   11.54770 1.263030          ?        ? 
1 1 1    9   39   11 o 54.73849 1.400915   54.35086    57.9   30.34279 1.533679          ?        ? 
1 1 1    9   39   12 o 9.378267 3.922886   3.887352   319.2  0.4510822 1.232958          ?        ? 
1 1 1    9   39   13 o 43.43364 1.834780   35.84547   192.4   19.51682 1.593824          ?        ? 
1 1 1    9   39   14 o 32.21714 2.380223   28.35051    46.2   11.12669 1.533679          ?        ? 
1 1 1    9   40    0 o 35.49199 2.264258   22.72954     0.0   12.84081 1.593824   12.84081 1.593824 
1 1 1    9   40    1 o 28.50536 1.898936   22.41030   153.7   8.209695 1.082597          ?        ? 
1 1 1    9   40    2 o 136.9255 1.207933   121.0894   336.8   188.2817 3.307936          ?        ? 
1 1 1    9   40    3 o 37.54752 1.721954   30.80210     7.9   14.22412 1.293102          ?        ? 
1 1 1    9   40    4 o 37.66231 1.676783   44.88139   298.8   14.31434 1.263030          ?        ? 
1 1 1    9   40    5 f 38.04096 1.660092   39.72187   305.9   14.61506 1.263030          ?        ? 
1 1 1    9   40    6 o 36.40768 1.775865   38.77356    66.8   13.41218 1.293102          ?        ? 
1 1 1    9   40    7 o 6.945866 3.264679   4.324139   286.0  -1.142741 1.172814          ?        ? 
1 1 1    9   40    8 o 12.17577 4.082781   13.24104   265.9   1.563751 1.172814          ?        ? 
1 1 1    9   40    9 o 26.06080 2.250149   29.26369    87.2   7.006810 1.172814          ?        ? 
1 1 1    9   40   10 o 34.36047 1.925431   29.20357    43.4   12.08900 1.323174          ?        ? 
1 1 1    9   40   11 o 10.32450 4.067933   4.763474   157.6  0.9021643 1.232958          ?        ? 
1 1 1    9   40   12 o 24.29032 2.599863   17.52845   146.8   6.285078 1.263030          ?        ? 
1 1 1    9   40   13 o 18.15099 4.218474   7.619178   333.6   4.119884 1.503607          ?        ? 
1 1 1    9   41    0 o 17.31570 5.009769   5.380736   180.0   3.759018 1.503607   3.759018 1.503607 
1 1 1    9   41    1 o 20.92229 2.587187   17.94709   230.2   4.480750 1.082597          ?        ? 
1 1 1    9   41    2 o 79.29498 1.156694   79.02124   225.4   63.18158 1.834401          ?        ? 
1 1 1    9   41    3 o 43.75518 1.512020   35.30905   103.7   19.30632 1.323174          ?        ? 
1 1 1    9   41    4 o 27.27693 2.204950   14.38975   300.4   7.578181 1.202886          ?        ? 
1 1 1    9   41    5 o 38.91964 1.661246   32.08707   304.7   15.33679 1.293102          ?        ? 
1 1 1    9   41    6 o 35.80022 1.763998   31.23713   228.4   13.02124 1.263030          ?        ? 
1 1 1    9   41    7 o 9.183591 3.832727   7.362555   358.8  0.3307936 1.172814          ?        ? 
1 1 1    9   41    8 o 30.00055 2.155131   27.63236   274.0   9.262220 1.293102          ?        ? 
1 1 1    9   41    9 o 36.49776 1.853876   34.93691   357.3   13.62268 1.353247          ?        ? 
1 1 1    9   41   10 o 8.205995 3.686666   8.394125   137.0 -0.3007214 1.263030          ?        ? 
1 1 1    9   41   11 o 29.76340 2.273340   15.22795    89.9   9.292293 1.353247          ?        ? 
1 1 1    9   41   12 o 30.49559 2.120146   25.38054   313.3   9.803518 1.293102          ?        ? 
1 1 1    9   42    0 o 12.71634 5.696741   10.03473   360.0   2.465916 1.533679   2.465916 1.533679 
1 1 1    9   42    1 o 39.24988 1.455726   34.88076    87.2   15.54730 1.142741          ?        ? 
1 1 1    9   42    2 o 30.64271 1.815553   19.87314   342.4   9.532870 1.112669          ?        ? 
1 1 1    9   42    3 o 67.37018 1.249841   66.60686   249.6   45.73973 1.684040          ?        ? 
1 1 1    9   42    4 o 22.64225 2.722693   24.40300   148.5   5.322770 1.232958          ?        ? 
1 1 1    9   42    5 o 56.46442 1.384723   41.52699   171.2   32.20727 1.563751          ?        ? 
1 1 1    9   42    6 o 25.70876 2.456419   21.52013   106.7   6.856449 1.263030          ?        ? 
1 1 1    9   42    7 o 34.10471 1.851695   38.88344   241.5   11.87850 1.263030          ?        ? 
1 1 1    9   42    8 o 37.75168 1.752471   33.23175   324.2   14.55492 1.323174          ?        ? 
1 1 1    9   42    9 o 14.36384 4.092693   16.91969   289.2   2.435844 1.232958          ?        ? 
1 1 1    9   42   10 o 13.67916 4.267901   19.58283   286.5   2.255411 1.293102          ?        ? 
1 1 1    9   42   11 o 30.51890 2.217063   31.55827   248.1   9.863664 1.353247          ?        ? 
1 1 1    9   43    0 o 26.65703 3.358102   24.46163   180.0   7.638325 1.744184   7.638325 1.744184 
1 1 1    9   43    1 o 39.97369 1.542212   30.68305   168.9   16.17881 1.232958          ?        ? 
1 1 1    9   43    2 o 27.60695 2.015198   20.46767   163.7   7.788685 1.112669          ?        ? 
1 1 1    9   43    3 o 29.25048 2.261800   25.40161   311.4   8.811138 1.323174          ?        ? 
1 1 1    9   43    4 o 34.36351 1.837749   26.17045   159.8   12.05893 1.263030          ?        ? 
1 1 1    9   43    5 o 16.41135 3.823789   9.555422   153.8   3.037287 1.232958          ?        ? 
1 1 1    9   43    6 o 26.11005 2.361079   28.44631    87.8   7.066954 1.232958          ?        ? 
1 1 1    9   43    7 o 23.70933 2.790409   31.18767   216.4   5.954284 1.323174          ?        ? 
1 1 1    9   43    8 o 42.29456 1.706440   37.92380   354.5   18.34401 1.443463          ?        ? 
1 1 1    9   43    9 o 20.17087 3.279915   19.81558   257.4   4.510822 1.323174          ?        ? 
1 1 1    9   43   10 o 31.25224 2.213151   25.37639    87.5   10.34482 1.383319          ?        ? 
1 1 1    9   44    0 o 68.32056 1.652756   41.08508     0.0   47.15312 2.255411   47.15312 2.255411 
1 1 1    9   44    1 o 60.77795 1.236968   46.75254   324.6   37.28946 1.503607          ?        ? 
1 1 1    9   44    2 o 24.66258 2.316752   22.65276    38.6   6.285078 1.142741          ?        ? 
1 1 1    9   44    3 o 29.76231 2.121862   22.11986   155.1   9.111859 1.263030          ?        ? 
1 1 1    9   44    4 o 31.95735 2.023169   24.49447    37.1   10.49518 1.293102          ?        ? 
1 1 1    9   44    5 o 43.52597 1.658163   25.92482   122.8   19.33639 1.443463          ?        ? 
1 1 1    9   44    6 o 27.18166 2.323313   25.45078    67.2   7.728541 1.263030          ?        ? 
1 1 1    9   44    7 o 11.94415 4.222766   7.450305   279.9   1.593824 1.263030          ?        ? 
1 1 1    9   44    8 o 8.214359 3.688633   11.23334   176.2 -0.1804329 1.263030          ?        ? 
1 1 1    9   44    9 o 30.15544 2.293647   23.47966    21.1   9.683230 1.383319          ?        ? 
1 1 1    9   45    0 o 32.17929 2.651564   23.40767   180.0   10.82597 1.684040   10.82597 1.684040 
1 1 1    9   45    1 o 13.93823 3.785968   14.80017    88.0   2.225339 1.082597          ?        ? 
1 1 1    9   45    2 o 35.56594 1.691064   28.53317    76.3   12.93102 1.202886          ?        ? 
1 1 1    9   45    3 o 32.16391 1.963428   11.85822    58.3   10.67561 1.263030          ?        ? 
1 1 1    9   45    4 o 44.68316 1.615220   28.29041    11.5   20.41899 1.443463          ?        ? 
1 1 1    9   45    5 o 11.82347 4.126767   8.283960   320.2   1.563751 1.202886          ?        ? 
1 1 1    9   45    6 o 17.25416 3.681469   17.56822   281.5   3.488369 1.232958          ?        ? 
1 1 1    9   45    7 o 8.805847 3.809896   11.02584   162.2  0.2706493 1.232958          ?        ? 
1 1 1    9   45    8 o 18.94127 3.622182   10.52266    21.4   4.270245 1.323174          ?        ? 
1 1 1    9   46    0 o 40.77869 2.151247   38.85287    -0.0   17.11105 1.744184   17.11105 1.744184 
1 1 1    9   46    1 o 22.04471 2.660080   19.77024   187.1   5.172409 1.172814          ?        ? 
1 1 1    9   46    2 o 7.215488 3.322837   2.081347   122.7 -0.6014429 1.112669          ?        ? 
1 1 1    9   46    3 o 9.620678 3.966241   13.19941   314.7  0.6315150 1.232958          ?        ? 
1 1 1    9   46    4 f 17.02647 3.805600   11.20015   189.1   3.458297 1.263030          ?        ? 
1 1 1    9   46    5 o 13.34793 4.227229   11.44772    98.1   2.225339 1.263030          ?        ? 
1 1 1    9   46    6 o 16.07702 4.240653   6.885284   117.1   3.277864 1.383319          ?        ? 
1 1 1    9   47    0 o 9.796739 5.392423   9.419463     0.0   1.684040 1.503607   1.684040 1.503607 
1 1 1    9   47    1 o 6.733561 3.182649   8.204721   235.1 -0.9923807 1.142741          ?        ? 
1 1 1    9   47    2 o 11.09466 3.959305   13.94634   339.5   1.413391 1.112669          ?        ? 
1 1 1    9   47    3 o 10.68264 4.138485   12.76998   342.6   1.202886 1.263030          ?        ? 
1 1 1    9   47    4 o 30.25202 2.236622   19.12399   359.7   9.743376 1.353247          ?        ? 
1 1 1   10    0    0 o 458.3007 5.513585   709.7964     0.0   2102.614 50.52120   2102.614 50.52120 
1 1 1   10    0    1 o 367.4473 3.171858   547.9554     0.0   1351.021 23.30591   1351.021 23.30591 
1 1 1   10    0    2 o 284.5518 2.526259   232.0179     0.0   810.0834 14.37449   810.0834 14.37449 
1 1 1   10    0    3 o 193.5405 1.864938   441.7618   180.0   374.7290 7.217315   374.7290 7.217315 
1 1 1   10    0    4 o 175.4532 1.611437   205.0011   180.0   307.9388 5.653563   307.9388 5.653563 
1 1 1   10    0    5 o 76.28037 1.025418   202.1115   180.0   58.21967 1.563751   58.21967 1.563751 
1 1 1   10    0    6 o 135.5112 1.531662   75.43553   180.0   183.7107 4.149956   183.7107 4.149956 
1 1 1   10    0    7 f 446.4794 4.277857   457.7069     0.0   1994.776 38.19162   1994.776 38.19162 
1 1 1   10    0    8 o 311.9537 3.191569   379.4390   180.0   973.7059 19.90776   973.7059 19.90776 
1 1 1   10    0    9 o 324.1955 2.783240   331.7418     0.0   1051.533 18.04329   1051.533 18.04329 
1 1 1   10    0   10 o 9.814543 3.642146   34.66991     0.0   1.293102 0.6615872   1.293102 0.6615872 
1 1 1   10    0   11 o 231.9847 2.483050   290.6862     0.0   538.5921 11.51763   538.5921 11.51763 
1 1 1   10    0   12 o 15.20299 3.652320   8.982924   180.0   2.676421 0.9623086   2.676421 0.9623086 
1 1 1   10    0   13 o 195.0410 2.182313   227.0364     0.0   380.8036 8.510417   380.8036 8.510417 
1 1 1   10    0   14 o 110.2524 1.446172   148.8837   180.0   121.6719 3.187647   121.6719 3.187647 
1 1 1   10    0   15 o 18.56882 3.514339   2.621927     0.0   3.789090 1.172814   3.789090 1.172814 
1 1 1   10    0   16 o 103.2060 1.428374   116.4343     0.0   106.6358 2.947070   106.6358 2.947070 
1 1 1   10    0   17 o 7.176595 4.361374   18.41746     0.0  0.5112265 1.142741  0.5112265 1.142741 
1 1 1   10    0   18 o 41.51287 2.333546   37.07255   180.0   17.44184 1.924617   17.44184 1.924617 
1 1 1   10    0   19 o 102.0479 1.961282   100.7414   180.0   104.5609 3.999595   104.5609 3.999595 
1 1 1   10    0   20 o 38.79412 1.869684   42.15001   180.0   15.21651 1.443463   15.21651 1.443463 
1 1 1   10    0   21 o 18.63201 5.050954   28.12078   180.0   4.270245 1.623896   4.270245 1.623896 
1 1 1   10    0   22 o 11.20891 6.212471   12.82820     0.0   2.014834 2.014834   2.014834 2.014834 
1 1 1   10    0   23 x        ?      ?   39.68188   180.0          ?        ?          ?        ? 
1 1 1   10    0   24 o 13.94296 6.648101   9.284523   180.0   3.518441 2.105050   3.518441 2.105050 
1 1 1   10    1    0 o 195.9939 1.849251   221.1155    -0.0   384.2919 7.247387   384.2919 7.247387 
1 1 1   10    1    1 f 241.9102 1.597399   375.8210     0.9   585.3242 7.728541          ?        ? 
1 1 1   10    1    2 o 217.4284 1.438406   394.3742   221.7   472.8243 6.255006          ?        ? 
1 1 1   10    1    3 o 270.9256 1.687167   370.1163    38.9   734.1513 9.141932          ?        ? 
1 1 1   10    1    4 o 177.2655 1.153584   288.8958   223.3   314.2539 4.089812          ?        ? 
1 1 1   10    1    5 o 459.6434 2.855799   629.6017    48.0   2113.380 26.25298          ?        ? 
1 1 1   10    1    6 o 209.8285 1.533499   258.2649    58.8   440.3163 6.435439          ?        ? 
1 1 1   10    1    7 o 299.9051 1.945281   222.0069    93.2   899.5781 11.66799          ?        ? 
1 1 1   10    1    8 o 111.1986 0.9330057   175.6190    60.1   123.6567 2.074978          ?        ? 
1 1 1   10    1    9 o 278.5964 1.867390   294.4022   285.6   776.3425 10.40496          ?        ? 
1 1 1   10    1   10 o 248.3022 1.707667   330.2052   188.8   616.7195 8.480345          ?        ? 
1 1 1   10    1   11 o 98.04554 0.9048125   131.7265   295.9   96.14065 1.774257          ?        ? 
1 1 1   10    1   12 o 138.2436 1.229045   189.2167   283.7   191.1686 3.398152          ?        ? 
1 1 1   10    1   13 o 146.6048 1.199975   192.4969   338.9   215.0158 3.518441          ?        ? 
1 1 1   10    1   14 o 69.91401 0.9247806   91.21091    69.1   48.89731 1.293102          ?        ? 
1 1 1   10    1   15 o 128.6445 1.203873   164.0656   324.6   165.6073 3.097431          ?        ? 
1 1 1   10    1   16 o 81.22231 1.018173   96.16502    18.8   66.00835 1.653968          ?        ? 
1 1 1   10    1   17 o 67.58517 1.001142   66.20655   281.2   45.70966 1.353247          ?        ? 
1 1 1   10    1   18 o 112.9510 1.584132   119.4251   106.1   127.8968 3.578585          ?        ? 
1 1 1   10    1   19 o 46.30672 1.331295   50.81977    43.4   21.50158 1.232958          ?        ? 
1 1 1   10    1   20 o 34.26319 1.316521   29.68722   104.9   11.78828 0.9021643          ?        ? 
1 1 1   10    1   21 o 17.54587 3.951394   14.07212   153.0   3.368080 1.353247          ?        ? 
1 1 1   10    1   22 o 18.92911 3.465245   17.50217   191.4   3.909379 1.263030          ?        ? 
1 1 1   10    1   23 o 23.33639 4.609866   27.38244   147.3   6.435439 2.074978          ?        ? 
1 1 1   10    1   24 o 12.18359 4.634210   6.984517    36.8   1.744184 1.563751          ?        ? 
1 1 1   10    2    0 o 122.9869 1.345194   226.5779   180.0   151.3230 3.307936   151.3230 3.307936 
1 1 1   10    2    1 o 76.18207 0.6907958   224.6995   184.8   58.03924 1.052525          ?        ? 
1 1 1   10    2    2 o 251.6336 1.631280   383.1184   276.3   633.3194 8.209695          ?        ? 
1 1 1   10    2    3 o 149.5730 1.025372   145.5211   313.7   223.7368 3.067359          ?        ? 
1 1 1   10    2    4 o 456.5874 2.631221   570.1000   329.1   2085.503 24.02764          ?        ? 
1 1 1   10    2    5 o 536.2632 3.566510   760.1510     3.3   2877.152 38.25177          ?        ? 
1 1 1   10    2    6 o 337.0397 2.386751   356.0567    20.1   1136.186 16.08860          ?        ? 
1 1 1   10    2    7 o 416.7086 2.587147   479.3937    99.1   1736.967 21.56173          ?        ? 
1 1 1   10    2    8 o 288.4763 1.876406   283.1774   236.0   832.3369 10.82597          ?        ? 
1 1 1   10    2    9 o 233.1885 1.760313   265.4281     2.7   543.8848 8.209695          ?        ? 
1 1 1   10    2   10 o 114.6823 1.075108   128.2105   295.1   131.5356 2.465916          ?        ? 
1 1 1   10    2   11 o 157.6756 1.172938   215.3211   125.1   248.6666 3.698874          ?        ? 
1 1 1   10    2   12 o 194.8887 1.396453   240.3820   248.6   379.9615 5.443058          ?        ? 
1 1 1   10    2   13 o 98.72481 1.005199   115.8969   339.1   97.49390 1.984761          ?        ? 
1 1 1   10    2   14 o 170.9850 1.398214   215.9956    18.8   292.6020 4.781471          ?        ? 
1 1 1   10    2   15 o 70.72509 0.9141752   68.94034   282.0   50.04005 1.293102          ?        ? 
1 1 1   10    2   16 o 19.74737 2.131980   21.72563   178.1   3.909379 0.8420200          ?        ? 
1 1 1   10    2   17 o 134.6592 1.462749   149.2865   287.2   181.6057 3.939451          ?        ? 
1 1 1   10    2   18 o 96.97346 1.116385   99.84349   340.8   94.15588 2.165194          ?        ? 
1 1 1   10    2   19 o 65.14232 1.154094   44.33263    80.0   42.52201 1.503607          ?        ? 
1 1 1   10    2   20 o 23.72909 2.471257   16.21015   325.9   5.713707 1.172814          ?        ? 
1 1 1   10    2   21 o 13.92913 4.066570   16.40774    80.3   2.105050 1.202886          ?        ? 
1 1 1   10    2   22 f 10.59793 4.261710   13.79717   329.8  0.7518036 1.383319          ?        ? 
1 1 1   10    2   23 o 10.63243 4.267462   13.84329    44.8  0.8720922 1.383319          ?        ? 
1 1 1   10    2   24 o 27.47059 5.001759   23.22833   333.5   9.863664 2.646349          ?        ? 
1 1 1   10    3    0 o 49.72478 0.8775296   20.45252     0.0   24.74938 0.8720922   24.74938 0.8720922 
1 1 1   10    3    1 o 180.6222 1.248689   141.7662   273.7   326.2828 4.510822          ?        ? 
1 1 1   10    3    2 o 115.6388 0.8841783   178.1039   239.7   133.7308 2.044906          ?        ? 
1 1 1   10    3    3 o 207.1924 1.364327   294.2731   173.4   429.3400 5.653563          ?        ? 
1 1 1   10    3    4 f 509.1906 3.484464   771.6459    25.9   2594.354 35.48513          ?        ? 
1 1 1   10    3    5 f 537.6985 3.590547   694.6227    19.5   2892.550 38.61263          ?        ? 
1 1 1   10    3    6 o 616.0830 4.073348   675.6022    59.9   3797.841 50.19041          ?        ? 
1 1 1   10    3    7 o 411.3405 3.180184   450.8487   222.0   1692.761 26.16277          ?        ? 
1 1 1   10    3    8 f 243.1937 1.669344   228.3422   281.4   591.5191 8.119479          ?        ? 
1 1 1   10    3    9 o 158.2154 1.282979   167.1101   278.8   250.3506 4.059740          ?        ? 
1 1 1   10    3   10 o 200.8646 1.579478   231.3432    53.7   403.5682 6.345222          ?        ? 
1 1 1   10    3   11 o 125.6368 1.160885   155.6961   180.1   157.8788 2.916998          ?        ? 
1 1 1   10    3   12 o 215.5420 1.499826   282.4937   190.2   464.7951 6.465511          ?        ? 
1 1 1   10    3   13 o 32.62257 1.014002   30.80931   147.8   10.64554 0.6615872          ?        ? 
1 1 1   10    3   14 o 109.9765 1.093766   115.1832    14.0   121.0103 2.405771          ?        ? 
1 1 1   10    3   15 o 98.22697 1.010294   113.5119   111.5   96.53159 1.984761          ?        ? 
1 1 1   10    3   16 o 163.2354 1.648819   166.9806   276.4   266.8602 5.382914          ?        ? 
1 1 1   10    3   17 o 90.43066 1.363429   83.36322    94.5   81.88644 2.465916          ?        ? 
1 1 1   10    3   18 o 34.67270 1.734630   43.98786    39.6   12.05893 1.202886          ?        ? 
1 1 1   10    3   19 f 63.61028 1.300079   67.21162   127.6   40.56732 1.653968          ?        ? 
1 1 1   10    3   20 o 45.90505 1.375698   41.38900   318.2   21.17079 1.263030          ?        ? 
1 1 1   10    3   21 o 42.23423 1.495268   34.35283   277.1   17.98314 1.263030          ?        ? 
1 1 1   10    3   22 o 54.96237 1.449923   51.50713    73.2   30.55330 1.593824          ?        ? 
1 1 1   10    3   23 o 13.34406 4.700584   23.05663   252.8   2.014834 1.563751          ?        ? 
1 1 1   10    3   24 o 16.74259 4.673475   25.08663   270.5   3.668802 1.623896          ?        ? 
1 1 1   10    4    0 o 145.7090 1.527626   146.9284   180.0   212.3996 4.450677   212.3996 4.450677 
1 1 1   10    4    1 o 189.5547 1.404020   292.7950   161.6   359.3621 5.322770          ?        ? 
1 1 1   10    4    2 o 128.5549 1.052660   267.5019   168.6   165.2765 2.706493          ?        ? 
1 1 1   10    4    3 o 405.9605 2.588975   584.0156    61.6   1648.735 21.02043          ?        ? 
1 1 1   10    4    4 o 252.7227 1.874134   336.0088    12.7   638.7925 9.472726          ?        ? 
1 1 1   10    4    5 o 473.5984 3.219305   575.6715    41.9   2243.773 30.49315          ?        ? 
1 1 1   10    4    6 o 354.5538 2.506338   382.6381   113.9   1257.377 17.77264          ?        ? 
1 1 1   10    4    7 o 294.8630 2.360995   379.2482   189.1   869.6563 13.92340          ?        ? 
1 1 1   10    4    8 o 149.7825 1.284942   242.8544   132.7   224.3683 3.849235          ?        ? 
1 1 1   10    4    9 o 128.0731 1.150542   153.7884   116.6   164.0435 2.947070          ?        ? 
1 1 1   10    4   10 o 166.8397 1.360856   212.5264    53.8   278.4079 4.540894          ?        ? 
1 1 1   10    4   11 o 36.03986 1.084737   46.26539    61.2   12.99117 0.7818757          ?        ? 
1 1 1   10    4   12 o 71.97627 0.8773934   58.55122   134.3   51.81431 1.263030          ?        ? 
1 1 1   10    4   13 o 64.57673 0.8149415   85.45938   243.5   41.71006 1.052525          ?        ? 
1 1 1   10    4   14 o 54.13861 0.9165184   64.95673   312.2   29.32034 0.9923807          ?        ? 
1 1 1   10    4   15 o 49.13008 0.9487430   43.75821    67.7   24.14793 0.9322364          ?        ? 
1 1 1   10    4   16 o 64.09123 1.173021   73.40553   101.9   41.10862 1.503607          ?        ? 
1 1 1   10    4   17 o 66.84107 1.102268   102.4353    78.5   44.71728 1.473535          ?        ? 
1 1 1   10    4   18 o 97.73045 1.323131   109.3684   162.6   95.68957 2.586205          ?        ? 
1 1 1   10    4   19 o 54.46265 1.325186   40.88536   197.4   29.74135 1.443463          ?        ? 
1 1 1   10    4   20 o 71.20969 1.351373   82.30592   206.9   50.94221 1.924617          ?        ? 
1 1 1   10    4   21 o 47.47112 1.552033   49.13288   265.8   22.73454 1.473535          ?        ? 
1 1 1   10    4   22 o 21.40061 2.810400   25.55566   269.5   4.781471 1.202886          ?        ? 
1 1 1   10    4   23 o 52.04866 1.848863   54.48069   122.4   27.81673 1.924617          ?        ? 
1 1 1   10    4   24 o 26.62548 2.541262   25.96088     4.5   7.638325 1.353247          ?        ? 
1 1 1   10    5    0 o 115.8907 1.570544   86.61895   180.0   134.3924 3.638730   134.3924 3.638730 
1 1 1   10    5    1 o 451.5606 3.156652   516.4065   189.9   2040.515 28.50839          ?        ? 
1 1 1   10    5    2 o 344.6158 2.473901   360.5765   264.6   1188.090 17.05091          ?        ? 
1 1 1   10    5    3 o 226.4058 1.580607   244.6678   170.4   512.6699 7.157170          ?        ? 
1 1 1   10    5    4 o 145.0841 1.119279   134.1621   240.4   210.5050 3.247792          ?        ? 
1 1 1   10    5    5 o 206.1411 1.611989   148.4394    43.1   424.9795 6.645944          ?        ? 
1 1 1   10    5    6 f 59.94593 0.8778955   97.34427   242.8   35.93621 1.052525          ?        ? 
1 1 1   10    5    7 o 261.7921 1.924078   259.5590    17.5   685.4644 10.07417          ?        ? 
1 1 1   10    5    8 o 385.1023 2.658921   437.1043     6.6   1483.639 20.47913          ?        ? 
1 1 1   10    5    9 o 195.2005 1.525171   150.4217   233.8   381.1043 5.954284          ?        ? 
1 1 1   10    5   10 o 78.31984 1.055906   125.7895   329.3   61.34718 1.653968          ?        ? 
1 1 1   10    5   11 o 37.22939 1.130854   41.84102   128.4   13.86326 0.8420200          ?        ? 
1 1 1   10    5   12 o 193.0900 1.674222   204.2181   169.5   373.0750 6.465511          ?        ? 
1 1 1   10    5   13 o 156.0801 1.406500   225.5846   216.6   243.7648 4.390533          ?        ? 
1 1 1   10    5   14 o 16.97644 2.037115   15.83802   323.9   2.886926 0.6916593          ?        ? 
1 1 1   10    5   15 o 55.18035 0.9809626   46.79915    19.3   30.46308 1.082597          ?        ? 
1 1 1   10    5   16 o 100.3056 1.094289   115.9140    75.6   100.6815 2.195267          ?        ? 
1 1 1   10    5   17 o 44.62104 1.347891   49.97903   149.9   19.93783 1.202886          ?        ? 
1 1 1   10    5   18 o 75.94975 1.148249   89.30584   247.0   57.76859 1.744184          ?        ? 
1 1 1   10    5   19 o 50.42213 1.401558   36.91724   113.5   25.50118 1.413391          ?        ? 
1 1 1   10    5   20 o 42.90046 1.577194   34.54357   162.5   18.52444 1.353247          ?        ? 
1 1 1   10    5   21 o 53.97546 1.420719   58.78444   232.1   29.35041 1.533679          ?        ? 
1 1 1   10    5   22 o 47.18465 1.848254   38.08529    29.5   22.70447 1.744184          ?        ? 
1 1 1   10    5   23 o 31.86298 2.595439   35.74773    28.8   10.70568 1.653968          ?        ? 
1 1 1   10    5   24 o 10.14684 4.315489   12.92476   142.5  0.6916593 1.533679          ?        ? 
1 1 1   10    6    0 o 127.2995 1.654246   163.1628    -0.0   162.1490 4.210100   162.1490 4.210100 
1 1 1   10    6    1 o 270.1741 2.070302   292.2679   195.0   730.1517 11.18684          ?        ? 
1 1 1   10    6    2 o 61.91967 0.8013454   70.85258   168.3   38.34198 0.9923807          ?        ? 
1 1 1   10    6    3 o 292.7067 2.116406   322.4413    10.1   856.9659 12.38972          ?        ? 
1 1 1   10    6    4 o 478.0271 2.988171   540.2099   193.5   2285.874 28.56854          ?        ? 
1 1 1   10    6    5 o 258.9639 2.142504   314.5380    64.1   670.7291 11.09662          ?        ? 
1 1 1   10    6    6 o 138.2696 1.326684   191.7362    21.9   191.1987 3.668802          ?        ? 
1 1 1   10    6    7 f 296.1212 2.097080   242.8757     7.8   877.0541 12.41980          ?        ? 
1 1 1   10    6    8 o 307.7578 2.433071   393.6753    90.7   947.4830 14.97593          ?        ? 
1 1 1   10    6    9 o 122.0727 1.244049   121.0889   289.6   149.0376 3.037287          ?        ? 
1 1 1   10    6   10 o 58.26466 1.006454   45.41055   155.4   33.95145 1.172814          ?        ? 
1 1 1   10    6   11 o 213.8144 1.800269   236.1042    46.7   457.4274 7.698469          ?        ? 
1 1 1   10    6   12 o 178.2763 1.560316   182.8762    43.5   318.0129 5.563347          ?        ? 
1 1 1   10    6   13 o 84.46091 1.032539   113.3249   120.6   71.36120 1.744184          ?        ? 
1 1 1   10    6   14 o 39.22716 1.226585   51.14776   123.0   15.39694 0.9623086          ?        ? 
1 1 1   10    6   15 f 109.3573 1.031212   143.0264    66.3   119.6571 2.255411          ?        ? 
1 1 1   10    6   16 o 19.12632 2.201208   16.64841   133.0   3.668802 0.8420200          ?        ? 
1 1 1   10    6   17 o 22.77379 1.980708   24.64997   230.7   5.202481 0.9021643          ?        ? 
1 1 1   10    6   18 o 19.68896 2.672882   44.29591   354.0   3.909379 1.052525          ?        ? 
1 1 1   10    6   19 o 41.31092 1.273907   45.19619   301.4   17.11105 1.052525          ?        ? 
1 1 1   10    6   20 f 88.02111 1.229929   73.42640   105.1   77.79664 2.165194          ?        ? 
1 1 1   10    6   21 o 24.36281 2.221824   26.69922   297.8   6.044501 1.082597          ?        ? 
1 1 1   10    6   22 o 45.51629 2.081173   35.96678    36.9   21.26101 1.894545          ?        ? 
1 1 1   10    6   23 o 9.180194 4.061353   9.439662    48.3      -0.06 1.473535          ?        ? 
1 1 1   10    6   24 o 12.41280 4.752977   16.14285   154.2   1.864473 1.653968          ?        ? 
1 1 1   10    7    0 o 307.4837 3.335888   332.8907     0.0   946.1298 20.50920   946.1298 20.50920 
1 1 1   10    7    1 o 180.4925 1.674446   328.1672    70.1   325.8317 6.044501          ?        ? 
1 1 1   10    7    2 o 268.5052 2.312766   212.8068   320.5   721.1602 12.41980          ?        ? 
1 1 1   10    7    3 o 104.4205 1.051167   48.15297   343.0   109.0416 2.195267          ?        ? 
1 1 1   10    7    4 o 350.9119 2.506641   465.9634    89.6   1231.665 17.59221          ?        ? 
1 1 1   10    7    5 o 448.5141 3.030587   598.3427   273.6   2012.308 27.18522          ?        ? 
1 1 1   10    7    6 o 286.9776 2.017192   349.4721   209.0   823.7061 11.57778          ?        ? 
1 1 1   10    7    7 o 363.8142 2.529334   459.6422   146.6   1324.016 18.40415          ?        ? 
1 1 1   10    7    8 f 201.3086 1.553587   195.0713   226.6   405.3124 6.255006          ?        ? 
1 1 1   10    7    9 o 150.2500 1.210892   207.6856   216.6   225.7817 3.638730          ?        ? 
1 1 1   10    7   10 o 26.63808 1.185362   33.23980   260.4   7.097026 0.6315150          ?        ? 
1 1 1   10    7   11 o 252.7418 1.856145   357.5579   319.7   639.1834 9.382509          ?        ? 
1 1 1   10    7   12 o 194.4843 1.700876   232.4882    79.3   378.5181 6.615872          ?        ? 
1 1 1   10    7   13 o 52.87449 1.052180   48.33814   317.1   27.96709 1.112669          ?        ? 
1 1 1   10    7   14 o 8.912402 3.441723   23.78657    44.1  0.5112265 0.8720922          ?        ? 
1 1 1   10    7   15 f 142.3180 1.415727   162.4656    35.7   202.7765 4.029667          ?        ? 
1 1 1   10    7   16 o 84.87624 0.9743410   85.89960    98.7   72.08293 1.653968          ?        ? 
1 1 1   10    7   17 o 87.29658 1.171241   86.22621   245.8   76.29303 2.044906          ?        ? 
1 1 1   10    7   18 o 69.36986 1.192137   78.00666    80.2   48.20565 1.653968          ?        ? 
1 1 1   10    7   19 o 92.17516 1.060312   111.0588   192.8   85.13425 1.954689          ?        ? 
1 1 1   10    7   20 o 49.53433 1.487388   55.97263   187.2   24.68923 1.473535          ?        ? 
1 1 1   10    7   21 o 25.47666 2.242723   20.93751   113.6   6.615872 1.142741          ?        ? 
1 1 1   10    7   22 o 53.62590 1.458019   51.17776   291.6   29.13991 1.563751          ?        ? 
1 1 1   10    7   23 o 14.42010 4.153206   17.86787   116.7   2.465916 1.263030          ?        ? 
1 1 1   10    7   24 o 17.33252 3.418234   17.30474    21.0   3.518441 1.142741          ?        ? 
1 1 1   10    8    0 o 103.8951 2.042362   10.05269     0.0   108.0793 4.240172   108.0793 4.240172 
1 1 1   10    8    1 o 330.4678 2.943808   434.1794   284.4   1092.581 19.45668          ?        ? 
1 1 1   10    8    2 o 54.86476 0.7673596   127.7356   110.9   30.10222 0.8420200          ?        ? 
1 1 1   10    8    3 o 424.1158 2.967395   480.7478    10.4   1799.337 25.17038          ?        ? 
1 1 1   10    8    4 o 216.2635 1.640829   287.2250   332.9   467.7422 7.097026          ?        ? 
1 1 1   10    8    5 o 87.96198 0.9230669   194.8106   100.5   77.37563 1.623896          ?        ? 
1 1 1   10    8    6 o 200.6263 1.431462   258.6479   214.4   402.5457 5.743780          ?        ? 
1 1 1   10    8    7 o 433.0244 2.739675   424.3447   237.6   1875.840 23.72692          ?        ? 
1 1 1   10    8    8 o 364.7037 2.329393   385.5757   247.9   1330.572 16.99076          ?        ? 
1 1 1   10    8    9 o 179.7797 1.463632   212.1436   323.8   323.2755 5.262625          ?        ? 
1 1 1   10    8   10 o 69.64285 0.9067909   84.32333    52.1   48.50637 1.263030          ?        ? 
1 1 1   10    8   11 o 58.75155 0.9213350   79.01601   180.9   34.52282 1.082597          ?        ? 
1 1 1   10    8   12 o 156.6717 1.324412   162.1297   191.3   245.5691 4.149956          ?        ? 
1 1 1   10    8   13 o 131.4313 1.212667   140.9086   224.6   172.8246 3.187647          ?        ? 
1 1 1   10    8   14 o 125.1506 1.081294   134.6324   266.5   156.7059 2.706493          ?        ? 
1 1 1   10    8   15 o 7.401704 3.277342   13.65197   149.0 -0.3307936 0.9623086          ?        ? 
1 1 1   10    8   16 o 43.29884 1.180693   54.72069   182.7   18.76502 1.022453          ?        ? 
1 1 1   10    8   17 o 38.15690 1.418613   18.75423   262.0   14.58499 1.082597          ?        ? 
1 1 1   10    8   18 o 128.0695 1.221018   138.6384   101.8   164.3142 3.127503          ?        ? 
1 1 1   10    8   19 o 50.00320 1.232879   45.25881    68.0   25.08017 1.232958          ?        ? 
1 1 1   10    8   20 o 54.52538 1.240933   59.49184   280.2   29.86164 1.353247          ?        ? 
1 1 1   10    8   21 o 46.24536 1.528144   59.77097   263.1   21.59180 1.413391          ?        ? 
1 1 1   10    8   22 o 24.97722 2.407966   36.35738   286.8   6.465511 1.202886          ?        ? 
1 1 1   10    8   23 o 20.51839 2.711395   22.57027   329.9   4.480750 1.112669          ?        ? 
1 1 1   10    8   24 o 34.05989 2.163153   31.59958   158.9   12.29951 1.473535          ?        ? 
1 1 1   10    9    0 x        ?      ?   171.4495     0.0          ?        ?          ?        ? 
1 1 1   10    9    1 o 555.6817 4.765053   452.4168   295.7   3090.785 52.95705          ?        ? 
1 1 1   10    9    2 o 193.4517 1.725500   375.3807    32.7   374.2779 6.676016          ?        ? 
1 1 1   10    9    3 o 192.5886 1.678581   242.2068    61.5   370.9399 6.465511          ?        ? 
1 1 1   10    9    4 f 175.2786 1.398277   139.2119   156.8   307.2471 4.901759          ?        ? 
1 1 1   10    9    5 o 204.0367 1.495967   260.1976   323.2   416.3488 6.104645          ?        ? 
1 1 1   10    9    6 o 109.6874 0.9869837   79.71249   199.9   120.3186 2.165194          ?        ? 
1 1 1   10    9    7 o 138.4330 1.086163   142.5505   262.4   191.6498 3.007215          ?        ? 
1 1 1   10    9    8 o 54.67199 0.7975677   58.35403   266.5   29.89171 0.8720922          ?        ? 
1 1 1   10    9    9 o 168.2929 1.375908   70.80025   194.8   283.2796 4.631110          ?        ? 
1 1 1   10    9   10 o 193.3221 1.501102   226.5415   341.1   373.8569 5.803924          ?        ? 
1 1 1   10    9   11 o 206.6823 1.615043   293.1998   169.0   427.3853 6.676016          ?        ? 
1 1 1   10    9   12 o 72.05707 0.9598771   82.74415   183.1   51.93459 1.383319          ?        ? 
1 1 1   10    9   13 o 136.3567 1.190918   170.9259   215.3   186.0263 3.247792          ?        ? 
1 1 1   10    9   14 o 27.84020 1.458229   50.87436   233.0   7.758613 0.8119479          ?        ? 
1 1 1   10    9   15 o 74.95037 0.9428845   107.6881    14.9   56.20484 1.413391          ?        ? 
1 1 1   10    9   16 o 51.42060 1.140412   72.93118   174.7   26.46349 1.172814          ?        ? 
1 1 1   10    9   17 o 98.51542 1.251538   103.6832    48.3   97.19318 2.465916          ?        ? 
1 1 1   10    9   18 o 60.24061 1.248001   56.66697   246.1   36.35722 1.503607          ?        ? 
1 1 1   10    9   19 o 25.75813 2.218215   24.12793    45.7   6.706088 1.142741          ?        ? 
1 1 1   10    9   20 o 42.00808 1.360145   41.64623   249.5   17.74257 1.142741          ?        ? 
1 1 1   10    9   21 o 24.69642 2.374461   22.87575   245.9   6.255006 1.172814          ?        ? 
1 1 1   10    9   22 o 41.89096 1.435734   43.18649   344.6   17.77264 1.202886          ?        ? 
1 1 1   10    9   23 o 33.25799 2.079679   37.74863    15.7   11.48756 1.383319          ?        ? 
1 1 1   10   10    0 o 634.7474 7.601644   856.8454   180.0   4035.080 96.47144   4035.080 96.47144 
1 1 1   10   10    1 o 461.5380 3.564054   531.2199    31.4   2131.153 32.89893          ?        ? 
1 1 1   10   10    2 o 280.2904 2.408644   250.5898   291.9   785.7852 13.50239          ?        ? 
1 1 1   10   10    3 o 146.4337 1.478618   109.3142    60.7   214.4445 4.330389          ?        ? 
1 1 1   10   10    4 o 384.3499 2.945796   520.6200   159.9   1477.745 22.64433          ?        ? 
1 1 1   10   10    5 o 615.6293 4.095889   633.4614   195.0   3792.789 50.43098          ?        ? 
1 1 1   10   10    6 o 229.9322 1.654456   292.8326    75.1   528.7585 7.608253          ?        ? 
1 1 1   10   10    7 o 340.6949 2.237571   373.5756    55.7   1161.085 15.24658          ?        ? 
1 1 1   10   10    8 o 75.12784 0.8405872   43.67995   102.3   56.44542 1.263030          ?        ? 
1 1 1   10   10    9 o 49.77664 0.9364197   69.30693   127.9   24.77945 0.9322364          ?        ? 
1 1 1   10   10   10 o 89.59915 0.9733264   157.1245   349.0   80.29263 1.744184          ?        ? 
1 1 1   10   10   11 o 216.2535 1.654810   288.0018    58.9   467.9226 7.157170          ?        ? 
1 1 1   10   10   12 o 60.95961 0.8879628   78.76392   170.1   37.16917 1.082597          ?        ? 
1 1 1   10   10   13 o 52.55928 1.001274   51.52614   109.0   27.63630 1.052525          ?        ? 
1 1 1   10   10   14 o 64.00785 0.9631302   70.82638   280.6   40.98833 1.232958          ?        ? 
1 1 1   10   10   15 o 50.80814 1.094972   59.56090   344.0   25.83197 1.112669          ?        ? 
1 1 1   10   10   16 o 98.12119 1.072679   96.41079    52.1   96.35115 2.105050          ?        ? 
1 1 1   10   10   17 o 79.60625 1.152171   89.74918   268.4   63.45222 1.834401          ?        ? 
1 1 1   10   10   18 o 42.70722 1.373086   55.95152    87.4   18.28386 1.172814          ?        ? 
1 1 1   10   10   19 o 30.56130 1.869589   34.08042   131.0   9.412581 1.142741          ?        ? 
1 1 1   10   10   20 o 36.52727 1.564231   40.57507    81.4   13.44225 1.142741          ?        ? 
1 1 1   10   10   21 f 52.80321 1.224454   55.76749   317.8   28.08738 1.293102          ?        ? 
1 1 1   10   10   22 o 23.34506 2.447502   14.79122   259.6   5.653563 1.142741          ?        ? 
1 1 1   10   10   23 o 8.393203 3.673719   3.471949   176.7       0.03 1.172814          ?        ? 
1 1 1   10   11    0 o 278.4373 3.684358   279.5189    -0.0   775.8613 20.50920   775.8613 20.50920 
1 1 1   10   11    1 o 338.2645 2.702599   340.0053   160.9   1144.516 18.28386          ?        ? 
1 1 1   10   11    2 o 146.5364 1.457059   123.5854   268.4   214.7452 4.270245          ?        ? 
1 1 1   10   11    3 f 195.4303 1.792662   328.9773   275.4   381.9764 7.006810          ?        ? 
1 1 1   10   11    4 o 214.1929 1.670730   191.8281   158.4   458.8408 7.157170          ?        ? 
1 1 1   10   11    5 o 246.7030 1.877201   218.1251   156.6   608.7203 9.262220          ?        ? 
1 1 1   10   11    6 o 344.6267 2.521816   425.0721   267.4   1188.090 17.38170          ?        ? 
1 1 1   10   11    7 o 259.6053 1.807072   217.7908   198.3   674.0972 9.382509          ?        ? 
1 1 1   10   11    8 o 90.60374 0.9127483   73.29185   162.5   82.09695 1.653968          ?        ? 
1 1 1   10   11    9 o 137.4242 1.148842   163.4943   316.3   188.8831 3.157575          ?        ? 
1 1 1   10   11   10 o 253.6202 1.867502   343.5123   354.0   643.6342 9.472726          ?        ? 
1 1 1   10   11   11 o 32.25143 1.165535   91.41245    10.4   10.40496 0.7518036          ?        ? 
1 1 1   10   11   12 o 116.7972 1.081387   145.5669   357.8   136.4674 2.526060          ?        ? 
1 1 1   10   11   13 o 95.59180 1.038144   111.0889   308.1   91.41932 1.984761          ?        ? 
1 1 1   10   11   14 f 50.98960 1.032098   63.64721   243.3   26.01241 1.052525          ?        ? 
1 1 1   10   11   15 o 84.13210 0.9829589   101.5749   337.4   70.81990 1.653968          ?        ? 
1 1 1   10   11   16 o 49.12103 1.071359   80.63847    85.8   24.14793 1.052525          ?        ? 
1 1 1   10   11   17 o 71.12426 1.057028   69.73736    63.4   50.64149 1.503607          ?        ? 
1 1 1   10   11   18 o 38.57343 1.286353   49.17580    22.5   14.91578 0.9923807          ?        ? 
1 1 1   10   11   19 o 24.10778 1.995846   24.10113   158.3   5.864068 0.9623086          ?        ? 
1 1 1   10   11   20 o 43.28658 1.389444   54.07763   182.1   18.85523 1.202886          ?        ? 
1 1 1   10   11   21 o 9.382060 3.771226   11.61052   198.0  0.5412986 1.082597          ?        ? 
1 1 1   10   11   22 o 8.633576 3.673936   10.65681    10.9  0.1804329 1.112669          ?        ? 
1 1 1   10   11   23 o 10.59269 4.091958   13.33290   227.8   1.082597 1.232958          ?        ? 
1 1 1   10   12    0 o 72.23715 1.312304   126.1421   180.0   52.23531 1.894545   52.23531 1.894545 
1 1 1   10   12    1 o 487.4812 3.796948   557.2822   185.2   2377.624 37.01881          ?        ? 
1 1 1   10   12    2 o 96.92270 1.210051   53.73755   136.6   93.94538 2.345627          ?        ? 
1 1 1   10   12    3 o 231.3277 2.092969   188.3744   139.8   535.2241 9.683230          ?        ? 
1 1 1   10   12    4 o 224.1376 1.757604   319.7231    16.0   502.4454 7.878902          ?        ? 
1 1 1   10   12    5 o 360.4494 2.557117   382.8946   125.9   1299.658 18.43423          ?        ? 
1 1 1   10   12    6 o 72.81084 0.9705909   55.39437    63.8   53.01719 1.413391          ?        ? 
1 1 1   10   12    7 o 321.5233 2.305520   340.1415   197.4   1034.211 14.82557          ?        ? 
1 1 1   10   12    8 o 55.46288 0.8946351   57.51193   231.2   30.76381 0.9923807          ?        ? 
1 1 1   10   12    9 o 68.62074 0.8764740   98.03036   267.7   47.09298 1.202886          ?        ? 
1 1 1   10   12   10 o 144.4330 1.270071   171.6452    82.4   208.6706 3.668802          ?        ? 
1 1 1   10   12   11 o 100.0573 1.006840   127.7817   112.7   100.1402 2.014834          ?        ? 
1 1 1   10   12   12 o 26.11863 1.439210   61.39907   299.0   6.826377 0.7518036          ?        ? 
1 1 1   10   12   13 o 28.05940 1.339665   59.56536   354.4   7.878902 0.7518036          ?        ? 
1 1 1   10   12   14 o 182.6635 1.539303   194.2298   238.7   334.0715 5.623491          ?        ? 
1 1 1   10   12   15 o 62.55371 1.033594   89.93685   275.4   39.15393 1.293102          ?        ? 
1 1 1   10   12   16 o 82.45882 1.075844   93.79572    20.2   68.05326 1.774257          ?        ? 
1 1 1   10   12   17 o 108.8122 1.188380   116.8248   106.0   118.5745 2.586205          ?        ? 
1 1 1   10   12   18 o 22.44924 2.344234   23.96405   181.0   5.082192 1.052525          ?        ? 
1 1 1   10   12   19 o 31.36180 1.582149   36.91018   182.5   9.893736 0.9923807          ?        ? 
1 1 1   10   12   20 o 21.54046 2.233723   33.57141   196.3   4.721327 0.9623086          ?        ? 
1 1 1   10   12   21 o 28.08912 2.034135   28.26916   277.2   8.059335 1.142741          ?        ? 
1 1 1   10   12   22 o 5.551723 2.741158   6.068615   177.4  -2.315555 1.112669          ?        ? 
1 1 1   10   12   23 o 7.897700 3.599071   12.25115   322.1 -0.4210100 1.263030          ?        ? 
1 1 1   10   13    0 o 28.61636 1.640110   76.03508   180.0   8.269840 0.9322364   8.269840 0.9322364 
1 1 1   10   13    1 o 83.84839 1.040082   140.6416   164.6   70.30868 1.744184          ?        ? 
1 1 1   10   13    2 o 280.9736 2.440247   337.9407   124.2   789.6644 13.71290          ?        ? 
1 1 1   10   13    3 o 304.0084 2.552105   304.9358   125.2   924.4778 15.51723          ?        ? 
1 1 1   10   13    4 o 309.7987 2.305412   306.3543    68.3   959.9931 14.28427          ?        ? 
1 1 1   10   13    5 o 272.3435 2.009642   244.2654   334.1   741.8798 10.94626          ?        ? 
1 1 1   10   13    6 o 450.2191 3.136001   471.5985   170.6   2028.306 28.23775          ?        ? 
1 1 1   10   13    7 o 53.19346 0.9610702   42.38909    96.5   28.29789 1.022453          ?        ? 
1 1 1   10   13    8 f 171.6065 1.472008   210.0067    53.8   294.5567 5.052120          ?        ? 
1 1 1   10   13    9 o 188.6718 1.402620   207.9639    76.1   356.0843 5.292697          ?        ? 
1 1 1   10   13   10 o 56.69393 0.9017305   62.85653   146.8   32.14712 1.022453          ?        ? 
1 1 1   10   13   11 o 124.9798 1.166988   173.0606   188.0   156.2549 2.916998          ?        ? 
1 1 1   10   13   12 o 82.60817 0.9828905   85.68267   167.8   68.26377 1.623896          ?        ? 
1 1 1   10   13   13 o 70.40509 0.9610431   99.70019   134.1   49.58897 1.353247          ?        ? 
1 1 1   10   13   14 o 11.64472 3.059205   13.18265   323.4   1.413391 0.7217315          ?        ? 
1 1 1   10   13   15 o 157.5307 1.298100   181.4639   289.4   248.4260 4.089812          ?        ? 
1 1 1   10   13   16 o 97.43487 1.095666   136.6420   337.4   95.02798 2.135122          ?        ? 
1 1 1   10   13   17 o 73.56247 1.083313   79.09897   140.7   54.19000 1.593824          ?        ? 
1 1 1   10   13   18 o 47.40535 1.205287   30.67430   340.8   22.52404 1.142741          ?        ? 
1 1 1   10   13   19 o 64.08118 1.126277   69.36570   189.8   41.19884 1.443463          ?        ? 
1 1 1   10   13   20 f 34.99225 1.375031   41.06966   259.9   12.32958 0.9623086          ?        ? 
1 1 1   10   13   21 o 11.81710 3.747510   13.45626   262.0   1.503607 0.9923807          ?        ? 
1 1 1   10   13   22 o 8.411073 3.628922   13.63107   327.8       0.09 1.112669          ?        ? 
1 1 1   10   13   23 o 17.32707 3.419289   18.67941   212.4   3.488369 1.142741          ?        ? 
1 1 1   10   14    0 o 169.5954 2.314954   175.7855     0.0   287.8205 7.848830   287.8205 7.848830 
1 1 1   10   14    1 f 70.65255 0.9363954   142.8495   334.0   49.91976 1.323174          ?        ? 
1 1 1   10   14    2 f 302.5320 2.519829   298.2834     5.2   915.5164 15.24658          ?        ? 
1 1 1   10   14    3 o 471.1036 3.293803   475.7144    87.0   2220.527 31.03445          ?        ? 
1 1 1   10   14    4 o 304.2864 2.263171   264.2556   109.9   926.1619 13.77304          ?        ? 
1 1 1   10   14    5 o 232.6149 1.816365   239.8257   107.8   541.2084 8.450273          ?        ? 
1 1 1   10   14    6 o 184.6409 1.530962   202.6457    32.0   340.9881 5.653563          ?        ? 
1 1 1   10   14    7 o 163.3795 1.389677   206.2355   351.8   266.9805 4.540894          ?        ? 
1 1 1   10   14    8 o 273.8716 2.053331   347.1498   296.8   750.4504 11.24698          ?        ? 
1 1 1   10   14    9 o 182.3261 1.525658   226.1933   150.7   332.5679 5.563347          ?        ? 
1 1 1   10   14   10 o 76.46992 1.002799   94.94006   222.9   58.49032 1.533679          ?        ? 
1 1 1   10   14   11 o 82.06182 0.9894345   93.06031   330.6   67.36160 1.623896          ?        ? 
1 1 1   10   14   12 o 54.08133 1.000897   74.87161   202.1   29.26020 1.082597          ?        ? 
1 1 1   10   14   13 o 67.52646 0.9797451   83.06791   168.4   45.61944 1.323174          ?        ? 
1 1 1   10   14   14 o 106.3644 1.159182   98.01716   338.8   113.2216 2.465916          ?        ? 
1 1 1   10   14   15 o 26.09987 1.785903   31.55125   260.4   6.826377 0.9322364          ?        ? 
1 1 1   10   14   16 o 112.3401 1.191214   117.8811    70.8   126.3632 2.676421          ?        ? 
1 1 1   10   14   17 o 28.85896 1.771466   48.16360   152.5   8.360056 1.022453          ?        ? 
1 1 1   10   14   18 o 59.07108 1.094531   47.89457   164.1   34.97390 1.293102          ?        ? 
1 1 1   10   14   19 o 25.95096 2.201733   27.49504    37.0   6.826377 1.142741          ?        ? 
1 1 1   10   14   20 o 56.55980 1.143128   61.29659   272.0   32.14712 1.293102          ?        ? 
1 1 1   10   14   21 o 22.19249 2.303602   22.33481   137.2   5.082192 1.022453          ?        ? 
1 1 1   10   14   22 o 23.06713 2.216255   23.07734   155.5   5.533275 1.022453          ?        ? 
1 1 1   10   14   23 o 15.39425 3.977357   15.64456    50.6   2.916998 1.232958          ?        ? 
1 1 1   10   15    0 o 384.7544 4.049660   330.3620   180.0   1481.414 31.15474   1481.414 31.15474 
1 1 1   10   15    1 o 349.2639 2.587350   354.2542   221.3   1220.237 18.07336          ?        ? 
1 1 1   10   15    2 o 649.0513 4.478033   652.6059   118.6   4216.896 58.12946          ?        ? 
1 1 1   10   15    3 o 210.8697 1.761235   176.5421   110.3   444.7370 7.427820          ?        ? 
1 1 1   10   15    4 o 180.0028 1.545350   142.0967   145.6   324.0574 5.563347          ?        ? 
1 1 1   10   15    5 o 233.7578 1.820349   293.6472   265.3   546.5612 8.510417          ?        ? 
1 1 1   10   15    6 o 140.5818 1.294168   159.3230   328.0   197.6642 3.638730          ?        ? 
1 1 1   10   15    7 o 119.9099 1.166171   204.3717   143.2   143.8050 2.796710          ?        ? 
1 1 1   10   15    8 o 126.7554 1.209952   207.7098    39.1   160.7056 3.067359          ?        ? 
1 1 1   10   15    9 o 173.3527 1.465853   199.8234    65.6   300.6312 5.082192          ?        ? 
1 1 1   10   15   10 o 55.34951 1.005130   62.35210     9.5   30.64352 1.112669          ?        ? 
1 1 1   10   15   11 o 206.0280 1.671258   238.4885    51.0   424.8593 6.886521          ?        ? 
1 1 1   10   15   12 o 85.00798 1.008207   111.9060    75.5   72.29343 1.714112          ?        ? 
1 1 1   10   15   13 o 83.97511 0.9668912   111.0336   343.2   70.54926 1.623896          ?        ? 
1 1 1   10   15   14 o 56.62863 1.035531   41.21606    66.6   32.08698 1.172814          ?        ? 
1 1 1   10   15   15 o 34.39753 1.442518   39.59738   195.9   11.84843 0.9923807          ?        ? 
1 1 1   10   15   16 o 14.14940 3.602638   7.624280   199.2   2.105050 1.022453          ?        ? 
1 1 1   10   15   17 o 75.32676 1.157746   91.77393   171.4   56.83635 1.744184          ?        ? 
1 1 1   10   15   18 o 30.03464 1.752185   33.97676   167.6   9.081788 1.052525          ?        ? 
1 1 1   10   15   19 o 76.48602 1.081222   77.76630   212.5   58.70082 1.653968          ?        ? 
1 1 1   10   15   20 o 21.01393 2.575903   27.88922    53.5   4.540894 1.082597          ?        ? 
1 1 1   10   15   21 o 12.12530 3.661683   14.97839   357.0   1.623896 0.9623086          ?        ? 
1 1 1   10   15   22 o 10.74181 3.748409   6.240554     0.9   1.232958 0.9923807          ?        ? 
1 1 1   10   15   23 o 8.832928 3.621634   10.77491   298.4  0.5713707 1.022453          ?        ? 
1 1 1   10   16    0 o 150.1796 2.053333   305.8864   180.0   225.6915 6.164790   225.6915 6.164790 
1 1 1   10   16    1 o 251.2888 2.028435   243.7767   318.6   631.6053 10.19446          ?        ? 
1 1 1   10   16    2 o 481.8607 3.398137   481.9101   318.5   2323.464 32.74857          ?        ? 
1 1 1   10   16    3 o 143.1302 1.218600   139.8217    95.4   204.8815 3.488369          ?        ? 
1 1 1   10   16    4 o 312.7518 2.317297   321.2009   193.9   978.5175 14.49477          ?        ? 
1 1 1   10   16    5 o 423.4179 3.032655   418.1631   310.2   1794.345 25.68161          ?        ? 
1 1 1   10   16    6 o 60.24397 0.9983454   81.09931   339.0   36.29708 1.202886          ?        ? 
1 1 1   10   16    7 o 253.4217 1.993562   250.5824   348.1   642.5515 10.10424          ?        ? 
1 1 1   10   16    8 o 160.8727 1.401985   184.8831    95.3   258.8911 4.510822          ?        ? 
1 1 1   10   16    9 o 43.41648 1.142862   47.64243   175.2   18.85523 0.9923807          ?        ? 
1 1 1   10   16   10 o 65.54484 1.009366   68.44996   130.8   42.97309 1.323174          ?        ? 
1 1 1   10   16   11 o 19.29232 2.338144   14.64551   330.7   3.728946 0.9021643          ?        ? 
1 1 1   10   16   12 o 72.30040 0.9982399   91.39941    72.1   52.29546 1.443463          ?        ? 
1 1 1   10   16   13 o 106.4525 1.129975   93.13401   249.8   113.4021 2.405771          ?        ? 
1 1 1   10   16   14 o 19.66360 2.370463   47.46398   327.0   3.879307 0.9322364          ?        ? 
1 1 1   10   16   15 o 15.76412 3.066244   26.17054   220.2   2.586205 0.9322364          ?        ? 
1 1 1   10   16   16 o 39.80892 1.397513   32.46570   132.7   15.87809 1.112669          ?        ? 
1 1 1   10   16   17 o 80.39627 1.196957   82.17869     0.6   64.77540 1.924617          ?        ? 
1 1 1   10   16   18 o 51.36369 1.170950   59.34627    61.6   26.46349 1.202886          ?        ? 
1 1 1   10   16   19 o 6.442301 3.049437   6.460747   310.5  -1.202886 1.052525          ?        ? 
1 1 1   10   16   20 o 18.28561 2.960244   18.97501   281.8   3.488369 1.082597          ?        ? 
1 1 1   10   16   21 o 8.510573 3.468571   8.478230    73.1  0.3909379 0.9322364          ?        ? 
1 1 1   10   16   22 f 8.663104 3.624166   14.59346   332.6  0.3608657 1.052525          ?        ? 
1 1 1   10   16   23 o 16.69057 3.269630   15.99557   209.6   3.247792 1.052525          ?        ? 
1 1 1   10   17    0 o 256.5385 2.919695   314.5625   180.0   658.5499 14.97593   658.5499 14.97593 
1 1 1   10   17    1 o 290.7180 2.286045   268.3219   347.8   845.4482 13.29189          ?        ? 
1 1 1   10   17    2 o 508.5921 3.311181   526.0561     1.2   2588.550 33.68080          ?        ? 
1 1 1   10   17    3 o 190.5880 1.514747   259.0120    52.3   363.3016 5.773852          ?        ? 
1 1 1   10   17    4 o 139.6390 1.238299   184.0691    65.1   195.0179 3.458297          ?        ? 
1 1 1   10   17    5 o 102.5419 1.143741   98.63832   112.9   105.1623 2.345627          ?        ? 
1 1 1   10   17    6 o 226.3376 1.853454   254.5533   107.1   512.4895 8.390128          ?        ? 
1 1 1   10   17    7 o 56.77303 1.032897   85.05915   248.4   32.23734 1.172814          ?        ? 
1 1 1   10   17    8 o 175.7445 1.505793   185.6408    22.7   308.9913 5.292697          ?        ? 
1 1 1   10   17    9 o 25.65468 1.582456   35.94072   115.7   6.585800 0.8119479          ?        ? 
1 1 1   10   17   10 o 35.61377 1.308815   38.85038   107.5   12.69044 0.9322364          ?        ? 
1 1 1   10   17   11 o 49.55146 1.213774   46.43954   344.6   24.56894 1.202886          ?        ? 
1 1 1   10   17   12 o 32.46944 1.574485   51.84576   189.7   10.55532 1.022453          ?        ? 
1 1 1   10   17   13 o 128.4324 1.229275   125.6000   247.3   165.0961 3.157575          ?        ? 
1 1 1   10   17   14 o 116.9867 1.156753   104.6407   259.9   136.9786 2.706493          ?        ? 
1 1 1   10   17   15 o 84.44840 1.139523   72.13184    93.5   71.39127 1.924617          ?        ? 
1 1 1   10   17   16 o 72.92715 1.092751   67.77195   274.4   53.25777 1.593824          ?        ? 
1 1 1   10   17   17 o 98.01619 1.135189   103.1722   323.6   96.26094 2.225339          ?        ? 
1 1 1   10   17   18 o 26.00693 1.965732   36.28600   172.2   6.826377 1.022453          ?        ? 
1 1 1   10   17   19 o 8.710161 3.661257   24.53462   213.5  0.1804329 1.082597          ?        ? 
1 1 1   10   17   20 o 8.320712 3.584616   5.963808   355.8       0.03 1.082597          ?        ? 
1 1 1   10   17   21 o 11.10245 3.911105   12.91816   257.6   1.263030 1.082597          ?        ? 
1 1 1   10   17   22 o 17.36100 3.238394   19.89318   215.9   3.398152 1.082597          ?        ? 
1 1 1   10   18    0 o 243.3897 2.941585   270.9040   180.0   592.8423 14.31434   592.8423 14.31434 
1 1 1   10   18    1 o 377.5217 2.891540   417.5060   111.2   1426.172 21.83238          ?        ? 
1 1 1   10   18    2 o 158.1182 1.293276   165.7206   183.3   250.0499 4.089812          ?        ? 
1 1 1   10   18    3 o 284.8814 2.016200   324.5713   138.4   811.8878 11.48756          ?        ? 
1 1 1   10   18    4 o 52.39567 1.004401   104.2825   130.5   27.45587 1.052525          ?        ? 
1 1 1   10   18    5 o 159.4380 1.395739   196.7058   130.8   254.2600 4.450677          ?        ? 
1 1 1   10   18    6 o 135.6107 1.341609   181.9879   186.9   183.9513 3.638730          ?        ? 
1 1 1   10   18    7 o 152.4987 1.370513   198.8067   148.6   232.6381 4.180028          ?        ? 
1 1 1   10   18    8 o 262.9144 2.070278   259.1271   241.9   691.8999 10.88612          ?        ? 
1 1 1   10   18    9 o 87.07363 1.087898   108.9472   309.0   75.84195 1.894545          ?        ? 
1 1 1   10   18   10 o 62.82654 1.005172   95.17577   233.0   39.48473 1.263030          ?        ? 
1 1 1   10   18   11 o 88.55255 1.171608   72.03597   331.4   78.45822 2.074978          ?        ? 
1 1 1   10   18   12 o 39.90422 1.394175   27.06541   244.3   15.93824 1.112669          ?        ? 
1 1 1   10   18   13 o 58.71354 1.024368   72.81250    30.7   34.49275 1.202886          ?        ? 
1 1 1   10   18   14 o 130.3982 1.233805   150.0635    97.7   170.2083 3.217719          ?        ? 
1 1 1   10   18   15 o 77.72492 1.063988   96.19759    68.2   60.47509 1.653968          ?        ? 
1 1 1   10   18   16 o 59.54193 1.212140   72.65528    91.6   35.51520 1.443463          ?        ? 
1 1 1   10   18   17 o 49.43523 1.247044   54.92485   110.0   24.50880 1.232958          ?        ? 
1 1 1   10   18   18 o 10.81832 3.750963   10.59197    30.5   1.112669 0.9923807          ?        ? 
1 1 1   10   18   19 o 8.012300 3.413340   12.32575   284.3       0.06 0.9623086          ?        ? 
1 1 1   10   18   20 o 9.641088 3.807655   10.89725   327.8  0.6615872 1.082597          ?        ? 
1 1 1   10   18   21 f 15.54264 3.639692   14.28904   116.8   2.736565 1.112669          ?        ? 
1 1 1   10   18   22 o 19.87878 2.798636   16.24740    42.5   4.300317 1.112669          ?        ? 
1 1 1   10   19    0 o 203.8531 2.479137   195.2333    -0.0   415.8677 10.10424   415.8677 10.10424 
1 1 1   10   19    1 o 217.0363 1.828968   213.9711   181.5   471.2004 7.939046          ?        ? 
1 1 1   10   19    2 o 108.4699 1.136682   133.0378   329.2   117.6723 2.465916          ?        ? 
1 1 1   10   19    3 o 115.1923 1.070348   143.3663     2.2   132.7084 2.465916          ?        ? 
1 1 1   10   19    4 o 24.94551 1.747994   48.95792   267.8   6.224934 0.8720922          ?        ? 
1 1 1   10   19    5 o 304.1354 2.091259   320.3857   182.0   925.5605 12.72052          ?        ? 
1 1 1   10   19    6 o 207.7348 1.758861   264.2630     4.7   431.7759 7.307531          ?        ? 
1 1 1   10   19    7 o 128.5711 1.379981   145.5847    67.8   165.3667 3.548513          ?        ? 
1 1 1   10   19    8 o 127.0859 1.301456   140.7771   120.6   161.5776 3.307936          ?        ? 
1 1 1   10   19    9 o 120.2007 1.263423   167.3750     9.7   144.5568 3.037287          ?        ? 
1 1 1   10   19   10 o 61.49251 1.051431   72.71098    94.2   37.83076 1.293102          ?        ? 
1 1 1   10   19   11 o 75.02705 1.142330   86.15933   239.2   56.32513 1.714112          ?        ? 
1 1 1   10   19   12 o 22.37746 2.217367   30.35934   353.6   5.022048 0.9923807          ?        ? 
1 1 1   10   19   13 o 61.82089 1.216100   61.10703    84.1   38.25177 1.503607          ?        ? 
1 1 1   10   19   14 o 55.97642 1.181903   77.15993     6.5   31.36525 1.323174          ?        ? 
1 1 1   10   19   15 o 101.8262 1.107481   102.1605   321.8   103.8090 2.255411          ?        ? 
1 1 1   10   19   16 o 9.897500 3.710643   8.003120   156.0  0.7518036 0.9923807          ?        ? 
1 1 1   10   19   17 o 40.97610 1.467789   39.03704   273.1   16.87047 1.202886          ?        ? 
1 1 1   10   19   18 o 30.00216 1.754082   28.23455    24.4   9.081788 1.052525          ?        ? 
1 1 1   10   19   19 o 15.27804 3.339719   9.186045    34.5   2.526060 0.9923807          ?        ? 
1 1 1   10   19   20 o 10.67694 3.985999   11.58293   154.6   1.052525 1.142741          ?        ? 
1 1 1   10   19   21 o 9.946032 3.835958   18.26384    83.1  0.8720922 1.082597          ?        ? 
1 1 1   10   19   22 o 16.31580 3.914761   19.49606    37.5   3.247792 1.263030          ?        ? 
1 1 1   10   20    0 o 365.1776 3.883758   340.9367     0.0   1335.053 28.35803   1335.053 28.35803 
1 1 1   10   20    1 o 240.0727 1.784993   261.8416   311.2   576.5432 8.570561          ?        ? 
1 1 1   10   20    2 o 127.7169 1.189070   138.2517   164.7   163.1414 3.037287          ?        ? 
1 1 1   10   20    3 o 141.4538 1.254301   158.9536   352.0   200.1301 3.548513          ?        ? 
1 1 1   10   20    4 o 290.4018 2.045183   296.7022   303.4   843.8545 11.87850          ?        ? 
1 1 1   10   20    5 o 95.94968 1.034272   136.5516    12.8   92.08091 1.984761          ?        ? 
1 1 1   10   20    6 o 57.43113 0.9686989   70.14319   335.7   32.98914 1.112669          ?        ? 
1 1 1   10   20    7 o 100.6197 1.255252   71.44488   254.4   101.2830 2.526060          ?        ? 
1 1 1   10   20    8 o 51.25744 1.144042   54.65144    74.4   26.28305 1.172814          ?        ? 
1 1 1   10   20    9 o 95.26282 1.120648   107.6957   176.2   90.78780 2.135122          ?        ? 
1 1 1   10   20   10 f 82.58410 1.092419   79.80402   182.7   68.23370 1.804329          ?        ? 
1 1 1   10   20   11 o 72.96046 1.009818   70.38141    94.0   53.25777 1.473535          ?        ? 
1 1 1   10   20   12 o 96.19689 1.266072   81.28748   199.3   92.62221 2.435844          ?        ? 
1 1 1   10   20   13 o 33.85983 1.731866   58.00414   140.3   11.48756 1.172814          ?        ? 
1 1 1   10   20   14 o 73.75042 1.243654   52.98967    40.0   54.46066 1.834401          ?        ? 
1 1 1   10   20   15 o 24.64422 2.135440   23.37564   348.9   6.104645 1.052525          ?        ? 
1 1 1   10   20   16 o 32.64685 1.704099   36.81557   188.4   10.70568 1.112669          ?        ? 
1 1 1   10   20   17 o 16.06561 3.295477   6.538383   309.9   2.736565 1.022453          ?        ? 
1 1 1   10   20   18 o 21.92835 2.468488   17.22534   180.7   4.901759 1.082597          ?        ? 
1 1 1   10   20   19 o 28.88737 1.821774   28.45500    78.8   8.480345 1.052525          ?        ? 
1 1 1   10   20   20 o 48.13822 1.405584   46.77321    42.5   23.45627 1.353247          ?        ? 
1 1 1   10   20   21 o 23.74307 2.406474   22.54342   247.0   5.924213 1.142741          ?        ? 
1 1 1   10   20   22 o 23.60243 2.675635   33.86497   225.3   6.074574 1.263030          ?        ? 
1 1 1   10   21    0 o 235.8875 2.780041   253.7844   180.0   556.9361 13.11145   556.9361 13.11145 
1 1 1   10   21    1 o 244.3388 1.883057   270.6147   219.9   597.2929 9.202076          ?        ? 
1 1 1   10   21    2 o 223.4799 1.735864   225.2898   148.2   499.6487 7.758613          ?        ? 
1 1 1   10   21    3 o 95.60480 1.053730   89.73363   190.3   91.41932 2.014834          ?        ? 
1 1 1   10   21    4 o 229.7090 1.728066   211.3515   180.2   527.9466 7.939046          ?        ? 
1 1 1   10   21    5 o 188.0017 1.463604   186.2928    76.3   353.5883 5.503202          ?        ? 
1 1 1   10   21    6 f 61.98632 0.9945403   105.3676   107.2   38.43220 1.232958          ?        ? 
1 1 1   10   21    7 o 81.40097 1.015939   43.92486    23.3   66.27901 1.653968          ?        ? 
1 1 1   10   21    8 o 84.24448 1.124433   105.4085   322.9   71.00034 1.894545          ?        ? 
1 1 1   10   21    9 o 118.3772 1.257482   98.85527    47.5   140.2264 2.977142          ?        ? 
1 1 1   10   21   10 o 245.9325 2.011474   247.0540   322.5   605.9838 9.893736          ?        ? 
1 1 1   10   21   11 o 20.84794 2.380045   42.92967    44.4   4.360461 0.9923807          ?        ? 
1 1 1   10   21   12 o 66.79379 1.305649   88.34087   120.2   44.65714 1.744184          ?        ? 
1 1 1   10   21   13 o 70.98211 1.165060   81.53429   325.1   50.43098 1.653968          ?        ? 
1 1 1   10   21   14 o 61.48048 1.320660   51.01659   115.6   37.86083 1.623896          ?        ? 
1 1 1   10   21   15 o 65.80758 1.051033   51.51179   138.3   43.36403 1.383319          ?        ? 
1 1 1   10   21   16 o 26.31125 2.114437   38.89627   110.9   6.976738 1.112669          ?        ? 
1 1 1   10   21   17 o 29.81547 1.765065   41.01903   173.0   8.961499 1.052525          ?        ? 
1 1 1   10   21   18 o 26.61107 2.034110   22.19851   276.3   7.187243 1.082597          ?        ? 
1 1 1   10   21   19 o 19.87676 2.874567   21.90050   342.8   4.119884 1.142741          ?        ? 
1 1 1   10   21   20 o 47.70105 1.449988   41.55542    78.1   23.06533 1.383319          ?        ? 
1 1 1   10   21   21 o 25.22933 2.383903   30.49603   139.3   6.706088 1.202886          ?        ? 
1 1 1   10   22    0 o 48.29598 1.779863   16.27653   360.0   23.42620 1.714112   23.42620 1.714112 
1 1 1   10   22    1 o 89.96590 1.052924   71.11618   357.9   80.95422 1.894545          ?        ? 
1 1 1   10   22    2 o 177.1286 1.443094   144.0036   323.0   313.8629 5.112265          ?        ? 
1 1 1   10   22    3 o 86.08971 0.9955384   95.23116    72.0   74.12784 1.714112          ?        ? 
1 1 1   10   22    4 o 255.8023 1.869206   264.4897   100.3   654.7908 9.562942          ?        ? 
1 1 1   10   22    5 o 179.2493 1.467963   215.6471   227.7   321.4712 5.262625          ?        ? 
1 1 1   10   22    6 o 95.66434 0.9902045   103.4735   226.9   91.53960 1.894545          ?        ? 
1 1 1   10   22    7 o 159.5678 1.356912   180.3944   174.4   254.7712 4.330389          ?        ? 
1 1 1   10   22    8 o 106.1404 1.104964   118.7147   284.2   112.7104 2.345627          ?        ? 
1 1 1   10   22    9 o 16.33945 2.484625   10.30817    18.2   2.676421 0.8119479          ?        ? 
1 1 1   10   22   10 o 26.84216 1.904565   50.79721   317.9   7.217315 1.022453          ?        ? 
1 1 1   10   22   11 o 180.4028 1.541923   163.2924    78.9   325.8918 5.563347          ?        ? 
1 1 1   10   22   12 f 43.73180 1.581594   33.48249    68.0   19.15596 1.383319          ?        ? 
1 1 1   10   22   13 o 88.79374 1.253094   88.53340    65.4   78.93938 2.225339          ?        ? 
1 1 1   10   22   14 o 93.32307 1.305060   104.5195   321.3   87.23930 2.435844          ?        ? 
1 1 1   10   22   15 o 46.45952 1.488735   50.26896    88.2   21.65195 1.383319          ?        ? 
1 1 1   10   22   16 o 46.56163 1.388592   45.04048    59.7   21.77223 1.293102          ?        ? 
1 1 1   10   22   17 o 13.69202 3.582706   14.26626    75.8   2.014834 0.9923807          ?        ? 
1 1 1   10   22   18 o 42.80311 1.440267   52.32883   119.9   18.46430 1.232958          ?        ? 
1 1 1   10   22   19 o 12.30140 3.852964   14.75851   263.0   1.653968 1.052525          ?        ? 
1 1 1   10   22   20 o 31.44106 1.960745   38.36209   165.6   10.16438 1.232958          ?        ? 
1 1 1   10   22   21 o 16.11848 3.373831   11.90965   203.5   3.007215 1.052525          ?        ? 
1 1 1   10   23    0 o 270.7066 3.050223   247.5674    -0.0   733.7302 16.50961   733.7302 16.50961 
1 1 1   10   23    1 o 137.8944 1.275774   147.8427   154.8   190.2063 3.518441          ?        ? 
1 1 1   10   23    2 o 125.3558 1.235456   149.5421   195.7   157.1871 3.097431          ?        ? 
1 1 1   10   23    3 o 79.43957 1.041023   77.13895   221.0   63.12143 1.653968          ?        ? 
1 1 1   10   23    4 o 45.80846 1.083185   52.08973    58.0   20.99036 0.9923807          ?        ? 
1 1 1   10   23    5 o 40.80975 1.142174   59.57491   320.5   16.65997 0.9322364          ?        ? 
1 1 1   10   23    6 o 88.30626 1.038658   113.3616    52.6   78.00714 1.834401          ?        ? 
1 1 1   10   23    7 o 255.2701 1.825981   234.8359    88.3   652.3851 9.322365          ?        ? 
1 1 1   10   23    8 o 55.15418 1.035952   87.69424   301.1   30.43301 1.142741          ?        ? 
1 1 1   10   23    9 o 41.92708 1.255185   63.86760   359.8   17.59221 1.052525          ?        ? 
1 1 1   10   23   10 o 71.39426 1.010910   89.13849    70.0   51.00236 1.443463          ?        ? 
1 1 1   10   23   11 o 37.53039 1.522422   51.22334   184.5   14.10384 1.142741          ?        ? 
1 1 1   10   23   12 o 112.1213 1.421517   135.6363   316.0   125.8820 3.187647          ?        ? 
1 1 1   10   23   13 o 49.78560 1.540284   54.56487   167.7   24.83959 1.533679          ?        ? 
1 1 1   10   23   14 o 42.54075 1.731910   42.20066    27.6   18.16358 1.473535          ?        ? 
1 1 1   10   23   15 o 63.84637 1.295272   76.92896    32.9   40.86804 1.653968          ?        ? 
1 1 1   10   23   16 o 28.20320 2.025908   26.39735    80.4   8.029263 1.142741          ?        ? 
1 1 1   10   23   17 o 5.976881 2.859204   3.949535    37.4  -1.263030 0.9623086          ?        ? 
1 1 1   10   23   18 o 37.79711 1.631022   28.89096   126.5   14.46470 1.232958          ?        ? 
1 1 1   10   23   19 f 12.54066 3.903571   21.78272   116.9   1.744184 1.082597          ?        ? 
1 1 1   10   23   20 o 6.622961 3.108399   6.521978   234.8 -0.9021643 1.052525          ?        ? 
1 1 1   10   23   21 o 29.16125 2.114035   35.22615   229.6   8.961499 1.232958          ?        ? 
1 1 1   10   24    0 o 158.3054 1.805174   160.7257   180.0   250.8017 5.713707   250.8017 5.713707 
1 1 1   10   24    1 o 120.9827 1.217972   161.1637    93.9   146.4213 2.947070          ?        ? 
1 1 1   10   24    2 o 124.7976 1.228934   128.3741    12.9   155.8038 3.067359          ?        ? 
1 1 1   10   24    3 o 53.63880 1.037187   35.42204   325.2   28.77904 1.112669          ?        ? 
1 1 1   10   24    4 o 68.83308 1.026680   61.25079   296.3   47.39370 1.413391          ?        ? 
1 1 1   10   24    5 o 83.44001 1.045173   121.2405   156.0   69.64709 1.744184          ?        ? 
1 1 1   10   24    6 o 34.58360 1.434756   24.20623   291.8   11.96871 0.9923807          ?        ? 
1 1 1   10   24    7 o 143.3954 1.237318   164.3520   243.5   205.7536 3.548513          ?        ? 
1 1 1   10   24    8 o 67.25918 0.9836386   79.24686   287.5   45.25858 1.323174          ?        ? 
1 1 1   10   24    9 o 73.36736 1.065700   88.27657     9.2   53.85921 1.563751          ?        ? 
1 1 1   10   24   10 o 46.28534 1.234453   46.27919   290.7   21.44144 1.142741          ?        ? 
1 1 1   10   24   11 o 123.4836 1.156775   124.4389   145.1   152.6161 2.856854          ?        ? 
1 1 1   10   24   12 o 42.39853 1.631328   12.53247   209.4   18.01322 1.383319          ?        ? 
1 1 1   10   24   13 o 48.25480 1.495668   50.60044   200.8   23.33598 1.443463          ?        ? 
1 1 1   10   24   14 o 79.15533 1.310700   85.85905   233.3   62.79064 2.074978          ?        ? 
1 1 1   10   24   15 o 19.80647 3.112513   33.20086    18.5   3.999595 1.232958          ?        ? 
1 1 1   10   24   16 o 29.35689 2.099947   22.44907   217.7   8.720922 1.232958          ?        ? 
1 1 1   10   24   17 o 16.39590 3.325641   22.12480   207.2   2.886926 1.052525          ?        ? 
1 1 1   10   24   18 o 30.19777 1.742720   33.63791   278.8   9.262220 1.052525          ?        ? 
1 1 1   10   24   19 o 21.62186 2.573019   22.22226   132.0   4.871688 1.112669          ?        ? 
1 1 1   10   24   20 o 5.706462 2.809316  0.4929833   103.9  -2.044906 1.112669          ?        ? 
1 1 1   10   24   21 o 10.83128 4.039200   13.37550    26.0   1.323174 1.172814          ?        ? 
1 1 1   10   25    0 o 70.60739 1.342689   69.77354   180.0   49.91976 1.894545   49.91976 1.894545 
1 1 1   10   25    1 o 113.8397 1.162314   102.9202    24.1   129.6410 2.646349          ?        ? 
1 1 1   10   25    2 o 129.5584 1.206986   104.9766   126.4   167.9229 3.127503          ?        ? 
1 1 1   10   25    3 o 73.45902 1.002964   101.2590    60.0   53.97950 1.473535          ?        ? 
1 1 1   10   25    4 o 59.33147 1.039042   76.66980    38.3   35.21448 1.232958          ?        ? 
1 1 1   10   25    5 o 47.51222 1.107636   71.42825    71.5   22.58418 1.052525          ?        ? 
1 1 1   10   25    6 o 66.58498 1.061344   76.38409   340.3   44.35641 1.413391          ?        ? 
1 1 1   10   25    7 f 54.60333 1.101477   95.12505    23.4   29.83157 1.202886          ?        ? 
1 1 1   10   25    8 o 111.7461 1.143723   131.6284   312.9   124.9498 2.556132          ?        ? 
1 1 1   10   25    9 o 139.0034 1.243961   156.7676   206.7   193.3940 3.458297          ?        ? 
1 1 1   10   25   10 o 106.6611 1.127764   111.4160   239.6   113.8531 2.405771          ?        ? 
1 1 1   10   25   11 o 89.38488 1.093412   79.24715   273.7   79.96183 1.954689          ?        ? 
1 1 1   10   25   12 o 62.40627 1.276974   78.42264   294.7   39.00357 1.593824          ?        ? 
1 1 1   10   25   13 o 49.16832 1.467879   52.13644   176.1   24.23815 1.443463          ?        ? 
1 1 1   10   25   14 o 49.77882 1.540494   55.91785   306.9   24.86966 1.533679          ?        ? 
1 1 1   10   25   15 o 8.148053 3.548266   14.40668    90.6 -0.1503607 1.082597          ?        ? 
1 1 1   10   25   16 o 9.157230 3.854717   19.67875   228.6  0.1804329 1.202886          ?        ? 
1 1 1   10   25   17 o 8.554571 3.732612   14.50331    26.7 -0.1202886 1.202886          ?        ? 
1 1 1   10   25   18 o 11.50534 4.021648   11.05414    39.9   1.353247 1.142741          ?        ? 
1 1 1   10   25   19 o 8.590672 3.665357   7.042852   344.3  0.1804329 1.112669          ?        ? 
1 1 1   10   25   20 o 16.32501 3.508678   22.01140   234.8   3.097431 1.112669          ?        ? 
1 1 1   10   26    0 o 107.2308 1.444870   128.6497   180.0   115.0861 3.097431   115.0861 3.097431 
1 1 1   10   26    1 o 115.3826 1.159802   131.3775    55.0   133.1895 2.676421          ?        ? 
1 1 1   10   26    2 o 153.0909 1.335747   173.3083   114.8   234.5026 4.089812          ?        ? 
1 1 1   10   26    3 o 87.27731 1.068131   109.1866   237.4   76.20281 1.864473          ?        ? 
1 1 1   10   26    4 o 164.1347 1.511534   169.2087    12.2   269.6569 4.961904          ?        ? 
1 1 1   10   26    5 o 100.8690 1.088177   102.3099   101.2   101.7942 2.195267          ?        ? 
1 1 1   10   26    6 o 16.51444 2.731440   36.02505    52.9   2.736565 0.9021643          ?        ? 
1 1 1   10   26    7 o 107.9878 1.099986   109.1045   306.7   116.6799 2.375700          ?        ? 
1 1 1   10   26    8 o 163.1245 1.401066   178.4246    75.0   266.4091 4.570966          ?        ? 
1 1 1   10   26    9 o 80.39958 1.103399   101.0131    45.5   64.68519 1.774257          ?        ? 
1 1 1   10   26   10 o 65.86984 1.118520   59.30225    17.9   43.42418 1.473535          ?        ? 
1 1 1   10   26   11 o 62.65965 1.151828   79.37398   356.7   39.30429 1.443463          ?        ? 
1 1 1   10   26   12 o 109.0696 1.254504   101.5122   145.5   119.1458 2.736565          ?        ? 
1 1 1   10   26   13 o 78.37503 1.151086   79.60948    76.1   61.52761 1.804329          ?        ? 
1 1 1   10   26   14 o 71.10833 1.205282   67.46561   215.1   50.70164 1.714112          ?        ? 
1 1 1   10   26   15 o 44.16021 1.464103   33.59796   108.2   19.60704 1.293102          ?        ? 
1 1 1   10   26   16 o 44.29189 1.595541   47.55661   194.4   19.78747 1.413391          ?        ? 
1 1 1   10   26   17 o 21.12650 2.989208   18.17499    63.2   4.661182 1.263030          ?        ? 
1 1 1   10   26   18 o 49.69706 1.512773   53.22874   215.9   25.05010 1.503607          ?        ? 
1 1 1   10   26   19 o 20.86680 2.738181   27.73007   290.3   4.631110 1.142741          ?        ? 
1 1 1   10   26   20 o 26.67492 2.254713   28.41282   214.4   7.548109 1.202886          ?        ? 
1 1 1   10   27    0 o 100.9893 1.459784   142.5963     0.0   102.0949 2.947070   102.0949 2.947070 
1 1 1   10   27    1 o 94.02185 1.071471   129.7234   322.8   88.44218 2.014834          ?        ? 
1 1 1   10   27    2 o 157.5813 1.364475   139.6749   313.0   248.5162 4.300317          ?        ? 
1 1 1   10   27    3 o 131.5151 1.200461   118.2418   283.8   173.0652 3.157575          ?        ? 
1 1 1   10   27    4 o 76.00984 1.008869   74.46497   246.0   57.79866 1.533679          ?        ? 
1 1 1   10   27    5 f 54.98571 1.121162   75.04588    89.2   30.25258 1.232958          ?        ? 
1 1 1   10   27    6 o 68.29956 1.034700   55.80003   307.9   46.67197 1.413391          ?        ? 
1 1 1   10   27    7 o 99.71977 1.070561   82.69400   309.1   99.50873 2.135122          ?        ? 
1 1 1   10   27    8 o 66.05470 1.160916   60.35342   246.1   43.66475 1.533679          ?        ? 
1 1 1   10   27    9 o 69.18539 1.108384   58.79153   154.1   47.90493 1.533679          ?        ? 
1 1 1   10   27   10 o 71.04652 1.100512   82.80653    48.1   50.52120 1.563751          ?        ? 
1 1 1   10   27   11 o 185.1317 1.510659   200.8235    69.6   343.4840 5.593419          ?        ? 
1 1 1   10   27   12 o 71.26194 1.054986   52.99326    15.6   50.85200 1.503607          ?        ? 
1 1 1   10   27   13 o 59.59164 1.312056   64.03766    62.4   35.60542 1.563751          ?        ? 
1 1 1   10   27   14 o 12.93033 4.128457   20.11794   322.0   1.714112 1.202886          ?        ? 
1 1 1   10   27   15 o 54.74397 1.373309   57.18718   348.4   30.13229 1.503607          ?        ? 
1 1 1   10   27   16 o 39.15649 1.651198   46.29424   304.5   15.48715 1.293102          ?        ? 
1 1 1   10   27   17 o 39.27917 1.607761   37.59902   133.3   15.63752 1.263030          ?        ? 
1 1 1   10   27   18 o 38.69563 1.670864   39.97820   222.4   15.24658 1.293102          ?        ? 
1 1 1   10   27   19 o 12.64745 4.080398   10.03392   160.8   1.864473 1.172814          ?        ? 
1 1 1   10   27   20 o 6.280602 3.038558   2.967358   122.6  -1.503607 1.172814          ?        ? 
1 1 1   10   28    0 o 124.3804 1.656821   108.3718     0.0   154.8716 4.119884   154.8716 4.119884 
1 1 1   10   28    1 o 124.4692 1.244256   119.7675   237.3   155.0219 3.097431          ?        ? 
1 1 1   10   28    2 o 63.20394 1.046750   64.14548   181.4   39.96588 1.323174          ?        ? 
1 1 1   10   28    3 o 140.8562 1.312996   145.5078   130.1   198.5664 3.698874          ?        ? 
1 1 1   10   28    4 o 122.1477 1.230975   132.1659   118.0   149.3082 3.007215          ?        ? 
1 1 1   10   28    5 o 96.91122 1.101587   130.0668   290.5   93.97545 2.135122          ?        ? 
1 1 1   10   28    6 o 30.05696 1.800910   20.80183    78.7   9.051716 1.082597          ?        ? 
1 1 1   10   28    7 o 56.11723 1.178938   63.28399   160.5   31.51561 1.323174          ?        ? 
1 1 1   10   28    8 o 127.8775 1.211094   124.9004    32.5   163.6827 3.097431          ?        ? 
1 1 1   10   28    9 o 96.08474 1.173657   71.25668   293.9   92.41170 2.255411          ?        ? 
1 1 1   10   28   10 o 137.0837 1.272350   125.5729   301.7   188.1915 3.488369          ?        ? 
1 1 1   10   28   11 o 175.1957 1.519092   152.5291   248.8   307.6982 5.322770          ?        ? 
1 1 1   10   28   12 o 68.52251 1.119106   55.13573   233.1   47.03283 1.533679          ?        ? 
1 1 1   10   28   13 o 35.12462 1.840735   29.82613   180.0   12.41980 1.293102          ?        ? 
1 1 1   10   28   14 o 52.07132 1.386044   70.97131   137.0   27.24536 1.443463          ?        ? 
1 1 1   10   28   15 o 52.90668 1.420999   46.27821   150.7   28.17760 1.503607          ?        ? 
1 1 1   10   28   16 o 47.86626 1.413570   50.10461    90.8   23.12548 1.353247          ?        ? 
1 1 1   10   28   17 o 31.55416 1.953717   44.57397    20.8   10.19446 1.232958          ?        ? 
1 1 1   10   28   18 o 37.02203 1.787009   32.65469    13.0   14.04369 1.323174          ?        ? 
1 1 1   10   28   19 o 21.71188 2.423846   23.49650    87.4   5.022048 1.052525          ?        ? 
1 1 1   10   29    0 o 95.74283 1.477023   67.30938   180.0   91.78019 2.826782   91.78019 2.826782 
1 1 1   10   29    1 o 111.7232 1.076666   99.96746   300.6   124.8896 2.405771          ?        ? 
1 1 1   10   29    2 o 89.91621 1.086951   98.39771   341.1   80.89407 1.954689          ?        ? 
1 1 1   10   29    3 o 111.3817 1.133966   108.0632   271.6   124.1378 2.526060          ?        ? 
1 1 1   10   29    4 o 67.40722 1.093010   54.18264   276.5   45.46908 1.473535          ?        ? 
1 1 1   10   29    5 o 79.81895 1.073750   52.11015   117.0   63.75294 1.714112          ?        ? 
1 1 1   10   29    6 o 26.50124 1.872329   42.19899   134.0   7.036882 0.9923807          ?        ? 
1 1 1   10   29    7 o 69.40267 1.104914   86.43561   326.6   48.20565 1.533679          ?        ? 
1 1 1   10   29    8 o 51.29367 1.348430   50.42695   239.2   26.34320 1.383319          ?        ? 
1 1 1   10   29    9 o 45.87675 1.376547   75.14209    36.7   21.08057 1.263030          ?        ? 
1 1 1   10   29   10 o 137.1031 1.294104   112.8275   158.9   188.2817 3.548513          ?        ? 
1 1 1   10   29   11 o 47.79056 1.289960   61.38850    48.7   22.88490 1.232958          ?        ? 
1 1 1   10   29   12 o 16.71764 3.445617   15.66447    70.7   2.947070 1.112669          ?        ? 
1 1 1   10   29   13 o 61.26804 1.300697   62.44747    87.6   37.68040 1.593824          ?        ? 
1 1 1   10   29   14 o 42.02867 1.645684   29.73421   333.5   17.80271 1.383319          ?        ? 
1 1 1   10   29   15 o 8.146994 3.593951   12.75170   250.8 -0.2405772 1.142741          ?        ? 
1 1 1   10   29   16 o 37.15747 1.699564   37.67015   260.1   14.01362 1.263030          ?        ? 
1 1 1   10   29   17 o 28.89622 2.185459   29.83112   210.7   8.600634 1.263030          ?        ? 
1 1 1   10   29   18 f 21.55002 2.790915   20.12954    74.6   4.961904 1.202886          ?        ? 
1 1 1   10   29   19 o 12.50649 4.134793   11.09889   286.6   1.924617 1.202886          ?        ? 
1 1 1   10   30    0 f 44.71082 1.652776   59.93850   180.0   20.08819 1.473535   20.08819 1.473535 
1 1 1   10   30    1 o 96.84701 1.055740   82.21783   132.6   93.85516 2.044906          ?        ? 
1 1 1   10   30    2 o 38.12786 1.419693   42.41774   307.1   14.55492 1.082597          ?        ? 
1 1 1   10   30    3 o 131.6302 1.267949   135.2057    72.5   173.4261 3.338008          ?        ? 
1 1 1   10   30    4 o 86.93696 1.106904   83.56784    40.6   75.63145 1.924617          ?        ? 
1 1 1   10   30    5 o 80.39650 1.140846   85.76568   183.7   64.68519 1.834401          ?        ? 
1 1 1   10   30    6 o 73.78617 1.141163   64.46996   191.9   54.49073 1.684040          ?        ? 
1 1 1   10   30    7 o 84.48994 1.156759   76.80842    84.4   71.45142 1.954689          ?        ? 
1 1 1   10   30    8 f 73.73708 1.141922   107.0247   151.5   54.43058 1.684040          ?        ? 
1 1 1   10   30    9 o 123.7134 1.239703   111.3678    37.4   153.2777 3.067359          ?        ? 
1 1 1   10   30   10 o 32.19470 1.774735   27.85321   103.6   10.40496 1.142741          ?        ? 
1 1 1   10   30   11 o 14.21827 3.902065   11.58154    36.4   2.135122 1.142741          ?        ? 
1 1 1   10   30   12 o 46.18680 1.302197   43.36193    30.5   21.41137 1.202886          ?        ? 
1 1 1   10   30   13 o 33.68405 1.919458   33.79786   268.7   11.45749 1.293102          ?        ? 
1 1 1   10   30   14 f 22.90925 2.756594   26.98686    74.7   5.382914 1.263030          ?        ? 
1 1 1   10   30   15 o 19.93313 3.092736   15.73536   152.7   4.149956 1.232958          ?        ? 
1 1 1   10   30   16 f 28.22128 2.237727   32.40570    76.1   8.209695 1.263030          ?        ? 
1 1 1   10   30   17 o 9.380959 3.896173   12.22641   159.1  0.4510822 1.202886          ?        ? 
1 1 1   10   30   18 o 12.38365 4.082782   13.62488   228.2   1.804329 1.172814          ?        ? 
1 1 1   10   31    0 o 129.5602 1.555636   119.4921   360.0   168.0431 4.029667   168.0431 4.029667 
1 1 1   10   31    1 o 56.73298 1.086632   70.68620   354.4   32.20727 1.232958          ?        ? 
1 1 1   10   31    2 o 23.23453 2.200288   26.76195   116.6   5.412986 1.022453          ?        ? 
1 1 1   10   31    3 o 145.4295 1.302724   140.7260    88.1   211.7079 3.789090          ?        ? 
1 1 1   10   31    4 o 84.03179 1.109385   75.98422   136.6   70.66954 1.864473          ?        ? 
1 1 1   10   31    5 o 52.74513 1.197295   45.13258   217.8   27.84681 1.263030          ?        ? 
1 1 1   10   31    6 o 136.3102 1.290601   116.7389   217.2   186.0263 3.518441          ?        ? 
1 1 1   10   31    7 o 76.94665 1.133373   63.34567   192.4   59.27220 1.744184          ?        ? 
1 1 1   10   31    8 o 140.0580 1.256066   137.7148   227.7   196.4613 3.518441          ?        ? 
1 1 1   10   31    9 o 42.87562 1.507969   39.67773     3.9   18.43423 1.293102          ?        ? 
1 1 1   10   31   10 o 46.53389 1.357108   45.55077   163.0   21.71209 1.263030          ?        ? 
1 1 1   10   31   11 o 44.53666 1.384206   51.50337    29.5   19.90776 1.232958          ?        ? 
1 1 1   10   31   12 o 8.968768 3.708813   2.816219   303.4  0.2706493 1.082597          ?        ? 
1 1 1   10   31   13 o 45.59313 1.517025   51.05566   309.1   20.93021 1.383319          ?        ? 
1 1 1   10   31   14 o 35.77410 1.849347   39.24277    57.3   12.96109 1.323174          ?        ? 
1 1 1   10   31   15 o 12.84132 4.236903   12.99191   326.9   1.774257 1.263030          ?        ? 
1 1 1   10   31   16 o 16.91708 3.576643   12.36475   242.6   3.187647 1.172814          ?        ? 
1 1 1   10   31   17 o 21.83253 2.892542   24.70568   215.8   5.112265 1.263030          ?        ? 
1 1 1   10   31   18 o 8.539886 3.705599   2.916357   236.7  0.2105050 1.172814          ?        ? 
1 1 1   10   32    0 o 56.34077 1.604136   31.08603   180.0   31.84640 1.804329   31.84640 1.804329 
1 1 1   10   32    1 o 162.4813 1.323327   159.8192   334.6   264.3041 4.300317          ?        ? 
1 1 1   10   32    2 o 105.5627 1.182230   82.33666   317.5   111.5376 2.495988          ?        ? 
1 1 1   10   32    3 o 139.7052 1.345339   122.5863    22.6   195.4088 3.759018          ?        ? 
1 1 1   10   32    4 o 61.18453 1.155023   79.82090   125.7   37.46989 1.413391          ?        ? 
1 1 1   10   32    5 o 112.4250 1.110068   99.31319   107.7   126.5135 2.495988          ?        ? 
1 1 1   10   32    6 o 41.28407 1.566103   41.95312   177.7   17.08098 1.293102          ?        ? 
1 1 1   10   32    7 o 63.29581 1.164007   67.91441   228.3   40.11624 1.473535          ?        ? 
1 1 1   10   32    8 o 51.88346 1.304121   60.55635   215.9   26.97471 1.353247          ?        ? 
1 1 1   10   32    9 o 70.64626 1.213166   60.96210    71.0   50.00998 1.714112          ?        ? 
1 1 1   10   32   10 o 59.16964 1.194355   69.37732   193.9   35.09419 1.413391          ?        ? 
1 1 1   10   32   11 o 69.84584 1.140958   62.59622   201.3   48.92738 1.593824          ?        ? 
1 1 1   10   32   12 o 34.22728 1.757203   36.95323    26.7   11.81835 1.202886          ?        ? 
1 1 1   10   32   13 o 13.51831 4.218036   13.26582    21.2   1.954689 1.263030          ?        ? 
1 1 1   10   32   14 o 8.747811 3.773677   9.411397   167.9       0.03 1.202886          ?        ? 
1 1 1   10   32   15 f 31.87728 2.075419   26.39470   185.3   10.43503 1.323174          ?        ? 
1 1 1   10   32   16 o 5.196296 2.603201   5.742627    49.0  -3.187647 1.172814          ?        ? 
1 1 1   10   32   17 o 12.14854 4.319399   7.881379    34.2   1.684040 1.323174          ?        ? 
1 1 1   10   32   18 o 15.37406 3.745702   26.27151    32.9   2.886926 1.142741          ?        ? 
1 1 1   10   33    0 o 197.3202 2.073192   179.8434   180.0   390.0658 8.179624   390.0658 8.179624 
1 1 1   10   33    1 o 77.13381 1.052649   68.88168   292.8   59.54285 1.623896          ?        ? 
1 1 1   10   33    2 o 58.82456 1.252483   25.72091   347.0   34.64311 1.473535          ?        ? 
1 1 1   10   33    3 f 134.1532 1.255311   119.4725   292.9   180.1923 3.368080          ?        ? 
1 1 1   10   33    4 o 45.67926 1.382498   35.21584    64.5   20.90014 1.263030          ?        ? 
1 1 1   10   33    5 o 42.07685 1.500861   48.14458    55.7   17.74257 1.263030          ?        ? 
1 1 1   10   33    6 o 74.48148 1.110322   82.39841   112.9   55.54325 1.653968          ?        ? 
1 1 1   10   33    7 o 118.0398 1.235600   118.5381   318.7   139.5949 2.916998          ?        ? 
1 1 1   10   33    8 o 91.20357 1.137553   98.02260   309.3   83.32992 2.074978          ?        ? 
1 1 1   10   33    9 o 58.57930 1.257727   58.90533   288.6   34.40253 1.473535          ?        ? 
1 1 1   10   33   10 o 42.91124 1.401598   37.16355    87.0   18.49437 1.202886          ?        ? 
1 1 1   10   33   11 o 50.56400 1.278679   53.39712   261.1   25.68161 1.293102          ?        ? 
1 1 1   10   33   12 o 28.89342 1.925472   34.52814   149.3   8.450273 1.112669          ?        ? 
1 1 1   10   33   13 o 29.97631 2.056554   23.98536    43.1   9.141932 1.232958          ?        ? 
1 1 1   10   33   14 o 13.56994 4.154169   23.68782   178.2   2.044906 1.232958          ?        ? 
1 1 1   10   33   15 o 37.71440 1.913677   44.80674   130.0   14.55492 1.443463          ?        ? 
1 1 1   10   33   16 o 10.02443 4.026608   9.764804   269.3  0.7818757 1.232958          ?        ? 
1 1 1   10   33   17 o 33.28376 2.168420   30.54505    28.5   11.69806 1.443463          ?        ? 
1 1 1   10   34    0 o 48.13892 1.817255   44.52976   180.0   23.30591 1.744184   23.30591 1.744184 
1 1 1   10   34    1 o 41.62217 1.336631   39.86479   334.2   17.35163 1.112669          ?        ? 
1 1 1   10   34    2 o 151.2893 1.401346   151.9592   145.7   229.3001 4.240172          ?        ? 
1 1 1   10   34    3 o 66.95853 1.212613   51.73690   354.4   44.89771 1.623896          ?        ? 
1 1 1   10   34    4 o 125.4437 1.186645   125.8562   279.0   157.5780 2.977142          ?        ? 
1 1 1   10   34    5 o 88.08737 1.126587   76.59431    49.4   77.70642 1.984761          ?        ? 
1 1 1   10   34    6 o 71.98564 1.169706   64.73924   276.9   51.90452 1.684040          ?        ? 
1 1 1   10   34    7 o 22.23445 2.569754   22.52532   174.1   4.991976 1.142741          ?        ? 
1 1 1   10   34    8 o 37.23475 1.615273   29.71745   327.8   13.92340 1.202886          ?        ? 
1 1 1   10   34    9 o 156.7670 1.477068   155.9610   331.9   246.9525 4.631110          ?        ? 
1 1 1   10   34   10 o 74.89468 1.084120   80.35051    24.8   56.26498 1.623896          ?        ? 
1 1 1   10   34   11 o 32.72361 1.883897   34.81348    41.7   10.82597 1.232958          ?        ? 
1 1 1   10   34   12 f 19.86072 2.801182   21.89895   199.1   4.059740 1.112669          ?        ? 
1 1 1   10   34   13 o 16.05428 3.954382   20.31562    73.4   2.886926 1.263030          ?        ? 
1 1 1   10   34   14 o 21.79176 3.035951   20.49487   186.1   5.022048 1.323174          ?        ? 
1 1 1   10   34   15 f 15.98697 4.040179   17.72671    96.0   2.977142 1.293102          ?        ? 
1 1 1   10   34   16 o 42.93045 1.716189   36.87134   288.4   18.97552 1.473535          ?        ? 
1 1 1   10   34   17 o 31.28058 2.403419   28.66311    33.5   10.52525 1.503607          ?        ? 
1 1 1   10   35    0 o 26.45607 2.902723   17.81160     0.0   7.277459 1.503607   7.277459 1.503607 
1 1 1   10   35    1 o 55.85743 1.184421   53.72923    94.3   31.24496 1.323174          ?        ? 
1 1 1   10   35    2 o 65.61636 1.214502   54.08264   248.9   43.12346 1.593824          ?        ? 
1 1 1   10   35    3 o 99.13542 1.122373   85.88069   203.7   98.42612 2.225339          ?        ? 
1 1 1   10   35    4 o 41.52489 1.520811   43.22833   103.9   17.29148 1.263030          ?        ? 
1 1 1   10   35    5 o 65.28692 1.197599   56.50082   228.7   42.70245 1.563751          ?        ? 
1 1 1   10   35    6 o 46.42350 1.457502   37.33410   238.8   21.62187 1.353247          ?        ? 
1 1 1   10   35    7 o 61.27372 1.251498   54.87666   164.7   37.65033 1.533679          ?        ? 
1 1 1   10   35    8 o 94.65427 1.143738   86.36038   251.3   89.85557 2.165194          ?        ? 
1 1 1   10   35    9 o 67.35127 1.294842   56.52617   252.0   45.55930 1.744184          ?        ? 
1 1 1   10   35   10 o 21.55869 2.720048   14.18839    27.7   4.751399 1.172814          ?        ? 
1 1 1   10   35   11 o 26.89718 2.236082   31.72832   244.9   7.367675 1.202886          ?        ? 
1 1 1   10   35   12 o 26.48684 2.213956   26.37064   284.7   7.187243 1.172814          ?        ? 
1 1 1   10   35   13 o 50.53233 1.577034   49.39835   142.0   25.92219 1.593824          ?        ? 
1 1 1   10   35   14 o 20.82242 3.177284   16.58102   145.1   4.631110 1.323174          ?        ? 
1 1 1   10   35   15 o 52.37036 1.607818   48.46005   216.0   28.05731 1.684040          ?        ? 
1 1 1   10   35   16 f 37.36106 1.931775   29.87493   272.0   14.58499 1.443463          ?        ? 
1 1 1   10   36    0 o 13.97221 5.440932   13.52871     0.0   2.706493 1.443463   2.706493 1.443463 
1 1 1   10   36    1 o 69.77048 1.077538   72.84396   175.8   48.74695 1.503607          ?        ? 
1 1 1   10   36    2 o 22.78198 2.573994   9.383615   296.7   5.232553 1.172814          ?        ? 
1 1 1   10   36    3 o 63.50530 1.254875   76.86448   271.4   40.41696 1.593824          ?        ? 
1 1 1   10   36    4 o 37.06981 1.703583   27.08528    32.6   13.80311 1.263030          ?        ? 
1 1 1   10   36    5 o 73.81828 1.181404   72.01740   315.7   54.61102 1.744184          ?        ? 
1 1 1   10   36    6 o 11.47527 3.922611   11.19974   160.3   1.263030 1.082597          ?        ? 
1 1 1   10   36    7 o 9.437492 3.780467   9.020189   221.1  0.4811543 1.082597          ?        ? 
1 1 1   10   36    8 o 34.93973 1.678338   37.19748   255.7   12.29951 1.172814          ?        ? 
1 1 1   10   36    9 o 28.26866 2.021216   30.64772   195.6   8.089407 1.142741          ?        ? 
1 1 1   10   36   10 o 50.13020 1.319738   44.48409   119.2   25.29067 1.323174          ?        ? 
1 1 1   10   36   11 o 33.02077 1.775873   29.76561   267.8   11.06655 1.172814          ?        ? 
1 1 1   10   36   12 f 36.78401 1.798573   39.07299   356.6   13.77304 1.323174          ?        ? 
1 1 1   10   36   13 o 16.77684 4.069072   14.32620   258.1   3.217719 1.353247          ?        ? 
1 1 1   10   36   14 o 21.60770 2.992225   11.28935   136.1   5.022048 1.293102          ?        ? 
1 1 1   10   36   15 o 9.532433 4.077656   15.36179   208.1  0.4510822 1.383319          ?        ? 
1 1 1   10   37    0 f 95.51962 1.448950   88.67914     0.0   91.44939 2.766637   91.44939 2.766637 
1 1 1   10   37    1 o 75.73352 1.131673   61.95332    96.7   57.46787 1.714112          ?        ? 
1 1 1   10   37    2 o 37.39672 1.648484   19.45260   239.8   14.04369 1.232958          ?        ? 
1 1 1   10   37    3 o 11.92547 4.082781   2.355810   146.0   1.353247 1.172814          ?        ? 
1 1 1   10   37    4 o 43.63350 1.481777   33.97793   318.1   19.12588 1.293102          ?        ? 
1 1 1   10   37    5 o 82.56194 1.201983   69.82792    56.2   68.38406 1.984761          ?        ? 
1 1 1   10   37    6 o 16.07935 3.637986   13.11083   308.4   2.766637 1.142741          ?        ? 
1 1 1   10   37    7 o 12.33682 3.973818   12.74546   115.4   1.563751 1.112669          ?        ? 
1 1 1   10   37    8 o 23.55352 2.489678   29.34176   166.1   5.653563 1.172814          ?        ? 
1 1 1   10   37    9 o 57.51024 1.333397   53.56459    10.4   33.28986 1.533679          ?        ? 
1 1 1   10   37   10 o 13.73829 4.082869   7.470746     2.8   2.074978 1.202886          ?        ? 
1 1 1   10   37   11 o 13.57113 4.092999   6.703741   342.0   2.044906 1.202886          ?        ? 
1 1 1   10   37   12 o 5.589609 2.755361   1.791816   346.9  -2.285483 1.112669          ?        ? 
1 1 1   10   37   13 o 26.48359 2.554877   22.49275   117.1   7.367675 1.353247          ?        ? 
1 1 1   10   37   14 o 23.55166 3.064461   27.65712    67.2   6.044501 1.443463          ?        ? 
1 1 1   10   37   15 o 15.07430 4.348063   10.19180   202.0   2.916998 1.383319          ?        ? 
1 1 1   10   38    0 o 48.30606 1.810892   32.65528     0.0   23.51642 1.744184   23.51642 1.744184 
1 1 1   10   38    1 o 84.51479 1.138628   89.92891   137.5   71.63185 1.924617          ?        ? 
1 1 1   10   38    2 o 30.10228 1.997998   23.01710   338.4   9.141932 1.202886          ?        ? 
1 1 1   10   38    3 o 33.53746 1.883014   44.37799   232.4   11.33720 1.263030          ?        ? 
1 1 1   10   38    4 f 82.43908 1.149058   75.22044   277.6   68.17355 1.894545          ?        ? 
1 1 1   10   38    5 o 58.37028 1.287991   54.31129   229.4   34.22210 1.503607          ?        ? 
1 1 1   10   38    6 o 43.76007 1.511852   45.59978   192.9   19.27625 1.323174          ?        ? 
1 1 1   10   38    7 o 19.47160 3.088821   25.05612   321.2   3.909379 1.202886          ?        ? 
1 1 1   10   38    8 o 56.64732 1.327165   53.28936   272.5   32.29749 1.503607          ?        ? 
1 1 1   10   38    9 o 15.25703 3.921263   8.421859   183.0   2.586205 1.202886          ?        ? 
1 1 1   10   38   10 o 22.58851 2.662605   24.59351   318.2   5.292697 1.202886          ?        ? 
1 1 1   10   38   11 o 20.00984 3.080880   18.30342   105.6   4.240172 1.232958          ?        ? 
1 1 1   10   38   12 f 27.79840 2.325858   32.22515    51.2   8.029263 1.293102          ?        ? 
1 1 1   10   38   13 o 23.18120 2.983708   3.148251   352.4   5.803924 1.383319          ?        ? 
1 1 1   10   38   14 o 19.99025 3.672492   18.44270   148.8   4.721327 1.413391          ?        ? 
1 1 1   10   39    0 o 30.63972 2.536426   36.41172   180.0   9.653158 1.533679   9.653158 1.533679 
1 1 1   10   39    1 o 60.66454 1.164923   52.95431   264.6   36.92860 1.413391          ?        ? 
1 1 1   10   39    2 o 74.32011 1.132964   64.39730   213.4   55.42296 1.684040          ?        ? 
1 1 1   10   39    3 o 40.00181 1.616305   32.37478   153.7   16.11867 1.293102          ?        ? 
1 1 1   10   39    4 f 59.78467 1.257519   50.51311   295.3   35.90614 1.503607          ?        ? 
1 1 1   10   39    5 o 42.34425 1.597911   34.22722    54.3   18.07336 1.353247          ?        ? 
1 1 1   10   39    6 o 44.92191 1.439278   35.15657   312.8   20.32877 1.293102          ?        ? 
1 1 1   10   39    7 o 45.02924 1.502631   45.30519     7.2   20.44906 1.353247          ?        ? 
1 1 1   10   39    8 o 37.44136 1.726837   25.52977   103.5   14.22412 1.293102          ?        ? 
1 1 1   10   39    9 o 23.68393 2.348997   20.23648   330.4   5.773852 1.112669          ?        ? 
1 1 1   10   39   10 o 33.34509 1.893877   25.09316   253.9   11.36727 1.263030          ?        ? 
1 1 1   10   39   11 o 14.38948 3.954851   24.76559    76.9   2.375700 1.172814          ?        ? 
1 1 1   10   39   12 o 40.02052 1.690691   34.23255   351.6   16.41939 1.353247          ?        ? 
1 1 1   10   39   13 o 9.135281 4.015471   5.188680    76.8  0.1804329 1.413391          ?        ? 
1 1 1   10   40    0 o 13.33568 5.684769   18.07421   180.0   2.616277 1.533679   2.616277 1.533679 
1 1 1   10   40    1 o 33.79932 1.645994   34.83977    24.5   11.51763 1.112669          ?        ? 
1 1 1   10   40    2 o 52.54258 1.316379   36.51854    24.7   27.75659 1.383319          ?        ? 
1 1 1   10   40    3 o 50.20033 1.467655   40.62715   285.8   25.38089 1.473535          ?        ? 
1 1 1   10   40    4 o 27.16010 2.048353   22.44502   107.5   7.487964 1.112669          ?        ? 
1 1 1   10   40    5 o 25.83670 2.211470   17.72114    72.3   6.796305 1.142741          ?        ? 
1 1 1   10   40    6 o 22.14231 2.648355   12.53844   281.2   5.052120 1.172814          ?        ? 
1 1 1   10   40    7 o 29.50643 2.089304   25.29703   290.1   8.901355 1.232958          ?        ? 
1 1 1   10   40    8 o 35.49080 1.864109   28.89981   131.5   12.84081 1.323174          ?        ? 
1 1 1   10   40    9 o 7.770952 3.498129   7.015411   335.8 -0.3909379 1.142741          ?        ? 
1 1 1   10   40   10 o 11.35422 4.063607   7.395964   178.6   1.323174 1.172814          ?        ? 
1 1 1   10   40   11 o 43.27979 1.667595   27.82111   272.0   19.18603 1.443463          ?        ? 
1 1 1   10   40   12 o 8.967582 3.843293   7.118413   188.1  0.3307936 1.232958          ?        ? 
1 1 1   10   40   13 o 22.65213 3.186153   22.19837    31.5   5.803924 1.443463          ?        ? 
1 1 1   10   41    0 o 12.08723 5.684346   14.14638   180.0   2.255411 1.533679   2.255411 1.533679 
1 1 1   10   41    1 o 12.16704 3.794858   15.81285     6.5   1.563751 1.022453          ?        ? 
1 1 1   10   41    2 o 48.31030 1.431702   46.26126   194.6   23.51642 1.383319          ?        ? 
1 1 1   10   41    3 o 44.94745 1.538818   33.43189     2.8   20.38891 1.383319          ?        ? 
1 1 1   10   41    4 f 20.60133 2.773465   16.70132   129.8   4.390533 1.142741          ?        ? 
1 1 1   10   41    5 o 26.42499 2.219138   13.60141   298.7   7.157170 1.172814          ?        ? 
1 1 1   10   41    6 o 18.52235 3.371850   12.58293   178.5   3.728946 1.202886          ?        ? 
1 1 1   10   41    7 o 12.38572 4.186163   7.096812   340.8   1.653968 1.232958          ?        ? 
1 1 1   10   41    8 o 26.62588 2.371809   23.27320    23.9   7.337603 1.263030          ?        ? 
1 1 1   10   41    9 o 11.98331 4.224165   13.79624   258.7   1.533679 1.263030          ?        ? 
1 1 1   10   41   10 o 36.46919 1.814099   28.95781   156.7   13.68283 1.323174          ?        ? 
1 1 1   10   41   11 o 40.01996 1.690714   33.12386   325.9   16.50961 1.353247          ?        ? 
1 1 1   10   41   12 o 18.55169 3.531250   15.91492   241.8   4.059740 1.263030          ?        ? 
1 1 1   10   42    0 o 10.81533 5.583254   20.96198   360.0   1.864473 1.533679   1.864473 1.533679 
1 1 1   10   42    1 o 31.74621 1.705081   26.73306   319.1   10.22453 1.082597          ?        ? 
1 1 1   10   42    2 o 28.52393 2.161269   28.18768    66.1   8.329985 1.232958          ?        ? 
1 1 1   10   42    3 o 13.76643 4.081160   6.679924   349.3   2.105050 1.202886          ?        ? 
1 1 1   10   42    4 o 63.80951 1.296020   50.82833    19.9   41.07855 1.653968          ?        ? 
1 1 1   10   42    5 o 33.86004 1.953888   35.43234    87.1   11.72814 1.323174          ?        ? 
1 1 1   10   42    6 o 14.36532 4.026324   19.13935   132.6   2.345627 1.202886          ?        ? 
1 1 1   10   42    7 o 19.72397 3.201764   7.281786   196.6   4.149956 1.263030          ?        ? 
1 1 1   10   42    8 o 13.47985 4.278101   14.14915   170.2   2.105050 1.293102          ?        ? 
1 1 1   10   42    9 o 12.68232 4.186159   8.355513   212.2   1.864473 1.232958          ?        ? 
1 1 1   10   42   10 o 30.94680 2.040647   21.67850   341.8   10.01402 1.263030          ?        ? 
1 1 1   10   42   11 o 18.96855 3.540162   19.98079   244.3   4.240172 1.293102          ?        ? 
1 1 1   10   43    0 o 25.63336 3.127235   28.73462   180.0   7.036882 1.563751   7.036882 1.563751 
1 1 1   10   43    1 o 12.95218 3.878267   15.43434   108.6   1.864473 1.082597          ?        ? 
1 1 1   10   43    2 f 62.40583 1.325171   68.76539    45.5   39.36444 1.653968          ?        ? 
1 1 1   10   43    3 o 21.60802 2.992182   29.44562    13.0   4.931832 1.293102          ?        ? 
1 1 1   10   43    4 o 23.08283 2.670725   20.53806   316.5   5.563347 1.232958          ?        ? 
1 1 1   10   43    5 o 11.72457 4.076519   12.59972   100.1   1.443463 1.172814          ?        ? 
1 1 1   10   43    6 o 51.01784 1.473609   33.06482   195.3   26.43342 1.503607          ?        ? 
1 1 1   10   43    7 o 7.261931 3.407712   9.221292   155.0  -1.022453 1.263030          ?        ? 
1 1 1   10   43    8 o 9.926270 4.040082   3.815273    13.2  0.7217315 1.263030          ?        ? 
1 1 1   10   43    9 o 37.50539 1.844160   23.33881   233.4   14.61506 1.383319          ?        ? 
1 1 1   10   43   10 o 16.41141 3.900275   8.321437   155.8   3.307936 1.263030          ?        ? 
1 1 1   10   44    0 o 14.04871 5.704572   12.89257   180.0   2.947070 1.563751   2.947070 1.563751 
1 1 1   10   44    1 o 47.68935 1.418814   39.30219   195.3   23.03526 1.353247          ?        ? 
1 1 1   10   44    2 o 35.06649 1.843786   28.93431   259.4   12.57016 1.293102          ?        ? 
1 1 1   10   44    3 o 41.60499 1.698583   23.68619   174.5   17.65235 1.413391          ?        ? 
1 1 1   10   44    4 o 40.76655 1.659751   24.31909   219.6   16.96069 1.353247          ?        ? 
1 1 1   10   44    5 o 18.52374 3.535908   9.213154   168.1   3.879307 1.263030          ?        ? 
1 1 1   10   44    6 o 17.73482 3.760058   6.066222   275.9   3.638730 1.293102          ?        ? 
1 1 1   10   44    7 o 21.54223 2.861723   17.96163    54.4   5.022048 1.232958          ?        ? 
1 1 1   10   44    8 o 47.72921 1.543641   37.95660   146.1   23.42620 1.473535          ?        ? 
1 1 1   10   44    9 o 27.42950 2.466772   25.01311    78.7   8.119479 1.353247          ?        ? 
1 1 1   10   45    0 o 19.74837 4.649745   12.85714     0.0   4.751399 1.593824   4.751399 1.593824 
1 1 1   10   45    1 o 20.32923 2.736624   17.00332   235.3   4.390533 1.112669          ?        ? 
1 1 1   10   45    2 o 37.33111 1.852769   38.41740   226.3   14.34441 1.383319          ?        ? 
1 1 1   10   45    3 o 14.54154 4.009018   9.961123   347.4   2.495988 1.202886          ?        ? 
1 1 1   10   45    4 o 31.84453 2.124771   23.46654   310.9   10.55532 1.353247          ?        ? 
1 1 1   10   45    5 o 10.60316 4.055295   13.91940   315.9   1.112669 1.202886          ?        ? 
1 1 1   10   45    6 o 16.46704 3.967431   18.51328   255.9   3.307936 1.293102          ?        ? 
1 1 1   10   45    7 o 28.17878 2.347821   31.51336    21.3   8.480345 1.323174          ?        ? 
1 1 1   10   46    0 o 7.808631 4.907630   4.937273   180.0  0.6615872 1.563751  0.6615872 1.563751 
1 1 1   10   46    1 o 21.60012 2.645221   14.79287   358.6   4.991976 1.142741          ?        ? 
1 1 1   10   46    2 o 27.30977 2.477586   26.54612   265.9   7.939046 1.353247          ?        ? 
1 1 1   10   46    3 o 29.70990 2.226825   19.49747    13.8   9.322365 1.323174          ?        ? 
1 1 1   10   46    4 o 47.25490 1.559135   37.22275   122.7   22.97512 1.473535          ?        ? 
1 1 1   10   46    5 o 21.15635 3.056062   16.32702   107.9   4.991976 1.293102          ?        ? 
1 1 1   10   47    0 o 5.503119 3.886579   8.804967   180.0  -1.232958 1.593824  -1.232958 1.593824 
1 1 1   10   47    1 f 22.51336 2.537918   22.50517     0.4   5.473131 1.142741          ?        ? 
1 1 1   10   47    2 o 14.47768 4.277359   9.610334   319.3   2.676421 1.323174          ?        ? 
1 1 1   10   47    3 o 17.66172 3.695095   15.33939     7.8   3.759018 1.263030          ?        ? 
1 1 1   11    0    1 o 73.26697 0.9443778   85.95872    90.0   53.70885 1.383319   53.70885 1.383319 
1 1 1   11    0    2 o 526.5477 5.052593   697.9797   270.0   2775.509 53.19762   2775.509 53.19762 
1 1 1   11    0    3 o 197.3350 1.897666   284.6156    90.0   389.5546 7.487964   389.5546 7.487964 
1 1 1   11    0    4 o 210.6774 1.877369   101.8610    90.0   443.9851 7.908974   443.9851 7.908974 
1 1 1   11    0    5 o 832.0052 12.85431   1107.628   270.0   6946.966 213.7829   6946.966 213.7829 
1 1 1   11    0    6 o 354.1878 3.443609   649.5018   270.0   1255.151 24.38851   1255.151 24.38851 
1 1 1   11    0    7 o 35.38463 1.278441   40.46252    90.0   12.57016 0.9021643   12.57016 0.9021643 
1 1 1   11    0    8 o 155.1255 1.784012   179.5915   270.0   240.7576 5.533275   240.7576 5.533275 
1 1 1   11    0    9 o 178.0131 1.748828   231.8591    90.0   317.0205 6.224934   317.0205 6.224934 
1 1 1   11    0   10 o 57.77457 0.9896147   41.03553   270.0   33.41015 1.142741   33.41015 1.142741 
1 1 1   11    0   11 o 116.7649 1.262299   82.91023    90.0   136.4073 2.947070   136.4073 2.947070 
1 1 1   11    0   12 o 82.61244 1.092472   146.7767   270.0   68.29385 1.804329   68.29385 1.804329 
1 1 1   11    0   13 o 155.6334 1.913568   191.1634    90.0   242.4717 5.954284   242.4717 5.954284 
1 1 1   11    0   14 o 8.776352 4.329921   22.83588   270.0   1.142741 0.9021643   1.142741 0.9021643 
1 1 1   11    0   15 o 69.17927 1.348710   63.53408   270.0   47.93500 1.864473   47.93500 1.864473 
1 1 1   11    0   16 o 72.09097 1.356783   62.80029   270.0   52.05489 1.954689   52.05489 1.954689 
1 1 1   11    0   17 o 46.64960 1.843470   27.27786   270.0   21.89252 1.714112   21.89252 1.714112 
1 1 1   11    0   18 o 110.0078 2.092923   133.3906   270.0   121.4614 4.601038   121.4614 4.601038 
1 1 1   11    0   19 o 71.25952 2.199056   62.50687    90.0   51.12265 3.127503   51.12265 3.127503 
1 1 1   11    0   20 o 19.58495 4.980146   23.86856    90.0   4.601038 1.684040   4.601038 1.684040 
1 1 1   11    0   21 o 13.43328 5.969472   5.454649   270.0   2.736565 1.684040   2.736565 1.684040 
1 1 1   11    0   22 o 12.85314 6.011298   18.50906    90.0   2.646349 1.714112   2.646349 1.714112 
1 1 1   11    0   23 o 19.41011 5.951417   27.08786   270.0   5.112265 2.014834   5.112265 2.014834 
1 1 1   11    0   24 x        ?      ?   6.203835   270.0          ?        ?          ?        ? 
1 1 1   11    1    0 o 186.1763 1.866036   278.3545   180.0   346.7619 6.946666   346.7619 6.946666 
1 1 1   11    1    1 o 453.9725 2.705995   687.0065   304.4   2061.927 24.56894          ?        ? 
1 1 1   11    1    2 o 96.31662 0.7961655   209.0914   136.3   92.77257 1.533679          ?        ? 
1 1 1   11    1    3 o 537.4090 3.102852   603.2285   340.0   2889.482 33.35001          ?        ? 
1 1 1   11    1    4 o 807.2520 6.424191   998.2223   109.0   6526.738 103.7188          ?        ? 
1 1 1   11    1    5 o 157.0294 1.043710   141.8971   110.6   246.5916 3.277864          ?        ? 
1 1 1   11    1    6 o 186.0557 1.276875   254.9887    95.3   346.1905 4.751399          ?        ? 
1 1 1   11    1    7 o 316.1290 2.206928   391.4054   216.1   999.5981 13.95348          ?        ? 
1 1 1   11    1    8 o 225.9407 1.543931   331.7694   234.6   510.5649 6.976738          ?        ? 
1 1 1   11    1    9 o 407.4590 2.601594   503.0878   214.0   1661.215 21.20086          ?        ? 
1 1 1   11    1   10 o 100.3510 0.8690416   107.6228   162.0   100.7116 1.744184          ?        ? 
1 1 1   11    1   11 o 99.59716 0.8303289   152.7177   229.5   99.20800 1.653968          ?        ? 
1 1 1   11    1   12 o 97.70389 0.8925870   132.5290   102.4   95.47906 1.744184          ?        ? 
1 1 1   11    1   13 o 126.5330 1.057598   119.1786   155.6   160.1642 2.676421          ?        ? 
1 1 1   11    1   14 o 102.8797 0.9938334   115.4746   300.8   105.8840 2.044906          ?        ? 
1 1 1   11    1   15 o 96.19180 1.141088   122.4725    95.4   92.59213 2.195267          ?        ? 
1 1 1   11    1   16 o 139.7351 1.237447   166.9143   221.6   195.4389 3.458297          ?        ? 
1 1 1   11    1   17 o 85.23769 1.252452   67.15144   117.9   72.74451 2.135122          ?        ? 
1 1 1   11    1   18 o 91.66469 1.443494   102.1079   286.8   84.23208 2.646349          ?        ? 
1 1 1   11    1   19 o 51.72612 1.715049   56.93975    58.4   26.88450 1.774257          ?        ? 
1 1 1   11    1   20 o 21.82391 2.893684   13.53280   265.5   4.871688 1.263030          ?        ? 
1 1 1   11    1   21 o 21.03478 2.287422   21.03676   288.0   4.510822 0.9623086          ?        ? 
1 1 1   11    1   22 o 25.79906 2.389541   22.80405   190.7   6.886521 1.232958          ?        ? 
1 1 1   11    1   23 x        ?      ?   16.35250   256.2          ?        ?          ?        ? 
1 1 1   11    1   24 o 12.63120 5.140788   14.32391   172.5   1.864473 2.044906          ?        ? 
1 1 1   11    2    0 o 355.4607 3.190015   431.9146    -0.0   1264.263 22.67440   1264.263 22.67440 
1 1 1   11    2    1 f 169.9013 1.212435   217.1065   333.6   288.6926 4.119884          ?        ? 
1 1 1   11    2    2 o 37.31366 0.6044464   113.2915   110.8   13.92340 0.4510822          ?        ? 
1 1 1   11    2    3 o 201.5240 1.335551   301.4391   218.9   406.1544 5.382914          ?        ? 
1 1 1   11    2    4 o 442.8658 2.583729   505.4131   162.6   1961.786 22.88490          ?        ? 
1 1 1   11    2    5 o 119.9668 0.9901485   59.12964   354.9   143.9253 2.375700          ?        ? 
1 1 1   11    2    6 o 285.2595 2.045154   372.3222   243.8   813.8725 11.66799          ?        ? 
1 1 1   11    2    7 o 142.6047 1.339073   112.6359   214.6   203.3779 3.819162          ?        ? 
1 1 1   11    2    8 o 196.9638 1.358839   264.0595   344.0   387.9908 5.352841          ?        ? 
1 1 1   11    2    9 o 73.26381 0.7798813   126.2439   307.5   53.67878 1.142741          ?        ? 
1 1 1   11    2   10 o 163.3633 1.233346   232.5578   347.8   266.9203 4.029667          ?        ? 
1 1 1   11    2   11 o 106.9323 0.9702297   135.4740   195.7   114.3644 2.074978          ?        ? 
1 1 1   11    2   12 o 122.4345 1.007035   178.5909    24.6   149.9397 2.465916          ?        ? 
1 1 1   11    2   13 o 88.93772 0.8960336   103.7338   222.8   79.11981 1.593824          ?        ? 
1 1 1   11    2   14 o 39.27009 0.9572216   41.62223   297.5   15.42701 0.7518036          ?        ? 
1 1 1   11    2   15 o 66.90065 0.9214842   92.82715   139.9   44.77742 1.232958          ?        ? 
1 1 1   11    2   16 o 42.91869 1.121084   50.76027   247.0   18.43423 0.9623086          ?        ? 
1 1 1   11    2   17 o 112.2096 1.232799   129.7010   331.5   126.0624 2.766637          ?        ? 
1 1 1   11    2   18 f 33.30088 1.670631   42.18274   339.9   11.12669 1.112669          ?        ? 
1 1 1   11    2   19 o 10.67655 4.063452   26.86267   300.0  0.8420200 1.202886          ?        ? 
1 1 1   11    2   20 o 38.67220 1.399710   38.90297   231.9   15.03607 1.082597          ?        ? 
1 1 1   11    2   21 o 19.84341 2.879399   9.188034   305.7   4.059740 1.142741          ?        ? 
1 1 1   11    2   22 o 44.73200 1.613457   45.81041   215.9   20.32877 1.443463          ?        ? 
1 1 1   11    2   23 o 33.94135 3.145311   31.83743    70.9   12.47994 2.135122          ?        ? 
1 1 1   11    2   24 o 35.76292 2.606712   32.76779    23.5   13.86326 1.864473          ?        ? 
1 1 1   11    3    0 o 54.28779 0.9700857   115.1918     0.0   29.50077 1.052525   29.50077 1.052525 
1 1 1   11    3    1 f 196.2833 1.325248   241.8515   183.6   385.3144 5.202481          ?        ? 
1 1 1   11    3    2 o 64.58260 0.6286120   87.99807    25.7   41.71006 0.8119479          ?        ? 
1 1 1   11    3    3 o 432.6039 2.565077   485.9123   136.6   1872.021 22.19324          ?        ? 
1 1 1   11    3    4 o 195.1276 1.371626   273.5834    89.2   380.7735 5.352841          ?        ? 
1 1 1   11    3    5 o 437.7388 3.026183   505.3115   189.5   1916.768 26.49356          ?        ? 
1 1 1   11    3    6 o 399.1162 2.780299   584.0180   260.1   1593.463 22.19324          ?        ? 
1 1 1   11    3    7 o 538.6501 3.640032   673.0266   296.9   2903.255 39.21407          ?        ? 
1 1 1   11    3    8 o 314.7697 2.058822   365.7272     2.7   991.0576 12.96109          ?        ? 
1 1 1   11    3    9 o 161.1330 1.203759   175.7331     6.4   259.6730 3.879307          ?        ? 
1 1 1   11    3   10 o 93.05884 0.9209830   117.9364   318.9   86.60778 1.714112          ?        ? 
1 1 1   11    3   11 o 87.54438 0.9961715   88.34794    25.6   76.65389 1.744184          ?        ? 
1 1 1   11    3   12 o 68.20106 0.8157274   80.54019   105.2   46.52161 1.112669          ?        ? 
1 1 1   11    3   13 o 88.80241 0.8973989   120.8190   252.5   78.87923 1.593824          ?        ? 
1 1 1   11    3   14 o 39.72632 0.9840778   69.20943   194.6   15.78788 0.7818757          ?        ? 
1 1 1   11    3   15 o 48.91507 0.8914351   60.03177   153.5   23.93743 0.8720922          ?        ? 
1 1 1   11    3   16 o 115.0174 1.032757   112.3499   340.4   132.3776 2.375700          ?        ? 
1 1 1   11    3   17 o 169.1153 1.671511   158.9236    99.9   286.6477 5.653563          ?        ? 
1 1 1   11    3   18 o 54.35704 1.106467   65.50687   194.6   29.59099 1.202886          ?        ? 
1 1 1   11    3   19 o 42.99088 1.503927   42.48077   171.2   18.55451 1.293102          ?        ? 
1 1 1   11    3   20 o 34.78984 1.772008   37.03433   124.8   12.20929 1.232958          ?        ? 
1 1 1   11    3   21 o 31.12850 1.980433   27.12789   219.2   9.833591 1.232958          ?        ? 
1 1 1   11    3   22 o 10.07133 4.254224   8.853046    36.2  0.3909379 1.473535          ?        ? 
1 1 1   11    3   23 o 20.02399 3.583698   20.63135   314.4   4.540894 1.383319          ?        ? 
1 1 1   11    3   24 o 9.736352 4.231329   17.19755   184.6  0.4510822 1.533679          ?        ? 
1 1 1   11    4    0 o 282.7721 2.627296   442.1736     0.0   799.9792 14.85564   799.9792 14.85564 
1 1 1   11    4    1 o 379.2335 2.335302   493.3418   275.4   1438.651 17.71249          ?        ? 
1 1 1   11    4    2 o 364.6107 2.420712   386.9769   121.7   1329.820 17.65235          ?        ? 
1 1 1   11    4    3 f 494.0688 3.073749   533.9148   349.0   2442.009 30.37287          ?        ? 
1 1 1   11    4    4 o 318.9143 2.098072   267.5386   174.8   1017.220 13.38210          ?        ? 
1 1 1   11    4    5 o 455.5369 3.086189   512.6029   200.4   2075.850 28.11745          ?        ? 
1 1 1   11    4    6 o 518.6294 3.487731   599.6746   217.7   2691.186 36.17679          ?        ? 
1 1 1   11    4    7 o 220.6077 1.717570   245.3262   286.7   486.7477 7.578181          ?        ? 
1 1 1   11    4    8 o 199.1127 1.706648   245.2042    95.9   396.5313 6.796305          ?        ? 
1 1 1   11    4    9 o 183.4473 1.467156   150.3870    31.4   336.5975 5.382914          ?        ? 
1 1 1   11    4   10 o 52.02135 0.9249170   69.18914   235.0   27.06493 0.9623086          ?        ? 
1 1 1   11    4   11 o 213.4700 1.662300   324.0933   351.7   455.9238 7.097026          ?        ? 
1 1 1   11    4   12 o 103.4959 1.104142   137.1038   307.7   107.1470 2.285483          ?        ? 
1 1 1   11    4   13 o 33.39598 1.035543   20.64198   193.4   11.15676 0.6916593          ?        ? 
1 1 1   11    4   14 o 94.98141 0.9340020   96.76643   192.8   90.24651 1.774257          ?        ? 
1 1 1   11    4   15 o 55.93661 0.9408196   45.39921    93.0   31.30510 1.052525          ?        ? 
1 1 1   11    4   16 o 34.27135 1.316208   23.41612   156.7   11.75821 0.9021643          ?        ? 
1 1 1   11    4   17 o 77.55489 1.066321   85.33144    72.6   60.20443 1.653968          ?        ? 
1 1 1   11    4   18 o 29.06592 1.758852   25.64957    79.6   8.480345 1.022453          ?        ? 
1 1 1   11    4   19 o 65.20486 1.106868   68.68694   340.3   42.61223 1.443463          ?        ? 
1 1 1   11    4   20 o 22.72768 2.580144   23.78833    85.7   5.262625 1.172814          ?        ? 
1 1 1   11    4   21 o 14.66874 3.607832   16.80646   180.4   2.345627 1.052525          ?        ? 
1 1 1   11    4   22 o 16.64815 3.623311   8.809090   351.8   3.097431 1.172814          ?        ? 
1 1 1   11    4   23 o 11.42672 4.424747   10.70434    66.2   1.263030 1.443463          ?        ? 
1 1 1   11    4   24 o 9.333525 3.990150   8.557301   160.2  0.4811543 1.323174          ?        ? 
1 1 1   11    5    0 o 244.2469 2.678625   394.8712     0.0   596.9020 13.08138   596.9020 13.08138 
1 1 1   11    5    1 o 173.1351 1.389534   113.1227    16.8   299.7892 4.811543          ?        ? 
1 1 1   11    5    2 o 82.62076 0.7643540   163.0889   225.5   68.26377 1.263030          ?        ? 
1 1 1   11    5    3 o 357.7277 2.336989   464.3675   221.5   1279.961 16.72011          ?        ? 
1 1 1   11    5    4 o 120.5049 0.8983842   107.8004   252.2   145.2184 2.165194          ?        ? 
1 1 1   11    5    5 o 474.7675 3.236714   496.3554   269.6   2254.930 30.73373          ?        ? 
1 1 1   11    5    6 o 32.06891 1.078396   85.96370    66.4   10.28467 0.6916593          ?        ? 
1 1 1   11    5    7 o 398.3254 2.793368   464.0644    97.2   1587.268 22.25339          ?        ? 
1 1 1   11    5    8 o 187.7641 1.769760   216.6038   256.4   352.6260 6.645944          ?        ? 
1 1 1   11    5    9 o 291.9597 2.142421   310.6590   140.3   852.7859 12.51001          ?        ? 
1 1 1   11    5   10 o 117.0288 1.117792   117.1891   248.0   136.9786 2.616277          ?        ? 
1 1 1   11    5   11 o 57.48384 0.9416534   101.9815   257.0   33.04929 1.082597          ?        ? 
1 1 1   11    5   12 o 69.57301 0.9941489   66.33338    52.3   48.41615 1.383319          ?        ? 
1 1 1   11    5   13 o 83.63909 1.006730   88.71549    39.7   69.97788 1.684040          ?        ? 
1 1 1   11    5   14 o 106.2834 1.018595   94.28317   133.9   113.0111 2.165194          ?        ? 
1 1 1   11    5   15 o 83.05276 0.9595248   100.0829   317.6   69.01557 1.593824          ?        ? 
1 1 1   11    5   16 o 54.26733 1.052882   40.72448   135.8   29.47070 1.142741          ?        ? 
1 1 1   11    5   17 o 156.7420 1.323817   188.8703   260.2   246.0503 4.149956          ?        ? 
1 1 1   11    5   18 o 9.385577 3.434782   12.98250   281.8  0.7217315 0.8420200          ?        ? 
1 1 1   11    5   19 o 47.00565 1.247524   42.82937   337.6   22.16317 1.172814          ?        ? 
1 1 1   11    5   20 o 7.254806 3.239630   20.37178    51.2 -0.3608657 0.9623086          ?        ? 
1 1 1   11    5   21 o 46.52839 1.324952   44.40606    42.0   21.80231 1.232958          ?        ? 
1 1 1   11    5   22 o 38.70908 1.670283   37.25129   293.2   15.24658 1.293102          ?        ? 
1 1 1   11    5   23 o 13.13491 3.994969   16.00580   330.3   2.014834 1.142741          ?        ? 
1 1 1   11    5   24 o 10.91922 4.045707   8.617667     0.4   1.353247 1.172814          ?        ? 
1 1 1   11    6    0 o 279.5556 3.028929   544.2403   180.0   781.9660 16.93062   781.9660 16.93062 
1 1 1   11    6    1 o 163.5258 1.397628   229.3000    22.6   267.4316 4.570966          ?        ? 
1 1 1   11    6    2 o 471.8430 3.282269   563.6041   108.1   2227.354 30.97431          ?        ? 
1 1 1   11    6    3 o 339.4065 2.440989   352.4319   277.8   1152.214 16.56975          ?        ? 
1 1 1   11    6    4 o 279.7056 1.876112   261.9936   294.9   782.4471 10.49518          ?        ? 
1 1 1   11    6    5 o 69.10305 1.087946   37.44185   274.6   47.75457 1.503607          ?        ? 
1 1 1   11    6    6 o 86.07796 1.048078   94.01917    42.5   74.09776 1.804329          ?        ? 
1 1 1   11    6    7 o 176.8348 1.615549   167.0301   260.3   312.7503 5.713707          ?        ? 
1 1 1   11    6    8 f 90.45551 0.8643761   95.25391   194.9   81.82631 1.563751          ?        ? 
1 1 1   11    6    9 o 70.54419 0.9591482   172.5742    67.8   49.76940 1.353247          ?        ? 
1 1 1   11    6   10 o 43.03662 1.083074   33.57865     2.2   18.52444 0.9322364          ?        ? 
1 1 1   11    6   11 o 39.53955 1.140838   84.97281   217.8   15.63752 0.9021643          ?        ? 
1 1 1   11    6   12 o 98.75564 1.050562   128.1181   308.8   97.55404 2.074978          ?        ? 
1 1 1   11    6   13 o 14.32985 2.934222   37.68853     8.6   2.135122 0.8119479          ?        ? 
1 1 1   11    6   14 o 26.96189 1.561501   31.00571   322.1   7.277459 0.8420200          ?        ? 
1 1 1   11    6   15 o 32.93126 1.324110   23.50900   157.0   10.85604 0.8720922          ?        ? 
1 1 1   11    6   16 o 62.55404 0.9614773   66.08662   250.9   39.15393 1.202886          ?        ? 
1 1 1   11    6   17 o 50.82293 1.183408   35.78526   291.3   25.86205 1.202886          ?        ? 
1 1 1   11    6   18 o 29.58593 1.626294   18.26087   183.2   8.781067 0.9623086          ?        ? 
1 1 1   11    6   19 o 46.35225 1.297549   48.09840   352.0   21.56173 1.202886          ?        ? 
1 1 1   11    6   20 o 35.70881 1.557976   38.18198   322.4   12.84081 1.112669          ?        ? 
1 1 1   11    6   21 o 14.06150 3.615950   18.42041    55.4   2.165194 1.022453          ?        ? 
1 1 1   11    6   22 o 30.20225 2.140738   37.65726   115.3   9.382509 1.293102          ?        ? 
1 1 1   11    6   23 o 12.60250 4.186157   14.24672   243.6   1.834401 1.232958          ?        ? 
1 1 1   11    6   24 o 41.34420 1.745666   34.36174   169.6   17.77264 1.443463          ?        ? 
1 1 1   11    7    0 o 718.2850 6.869625   760.8614   180.0   5165.914 98.66671   5165.914 98.66671 
1 1 1   11    7    1 o 44.98669 0.8021612   158.7786   195.8   20.23855 0.7217315          ?        ? 
1 1 1   11    7    2 o 331.5780 2.416996   429.3682    98.6   1099.678 16.02845          ?        ? 
1 1 1   11    7    3 o 150.0466 1.152408   258.9210   206.6   225.1501 3.458297          ?        ? 
1 1 1   11    7    4 o 132.4737 1.146374   150.1245    22.8   175.5010 3.037287          ?        ? 
1 1 1   11    7    5 o 119.1732 1.173380   46.98978    73.8   142.0307 2.796710          ?        ? 
1 1 1   11    7    6 o 412.1182 3.177831   423.7044   104.0   1699.196 26.19284          ?        ? 
1 1 1   11    7    7 o 87.17068 1.069438   144.3997   152.0   75.99231 1.864473          ?        ? 
1 1 1   11    7    8 o 159.9811 1.315812   216.2275   172.5   255.9741 4.210100          ?        ? 
1 1 1   11    7    9 o 73.11804 1.028205   131.3725   335.9   53.46827 1.503607          ?        ? 
1 1 1   11    7   10 o 128.6846 1.273604   162.0320   188.6   165.6374 3.277864          ?        ? 
1 1 1   11    7   11 o 203.0196 1.747867   239.1090   151.1   412.4094 7.097026          ?        ? 
1 1 1   11    7   12 o 74.17276 1.054128   86.75310   207.7   55.03202 1.563751          ?        ? 
1 1 1   11    7   13 o 90.63642 1.111492   108.9604   158.4   82.18716 2.014834          ?        ? 
1 1 1   11    7   14 o 97.30131 1.066264   83.54988   162.1   94.72726 2.074978          ?        ? 
1 1 1   11    7   15 o 52.17049 1.325767   66.39402   168.2   27.24536 1.383319          ?        ? 
1 1 1   11    7   16 o 39.75375 1.172514   49.60140   267.6   15.81795 0.9322364          ?        ? 
1 1 1   11    7   17 o 61.27755 1.079657   77.56738   342.5   37.59018 1.323174          ?        ? 
1 1 1   11    7   18 o 119.7594 1.155081   130.3088   237.2   143.6546 2.766637          ?        ? 
1 1 1   11    7   19 o 51.32811 1.230349   51.33567   191.3   26.43342 1.263030          ?        ? 
1 1 1   11    7   20 o 9.247927 3.647711  0.4055808    68.3  0.5412986 0.9923807          ?        ? 
1 1 1   11    7   21 o 42.81052 1.404895   56.92453    60.3   18.49437 1.202886          ?        ? 
1 1 1   11    7   22 f 6.977441 3.125704   11.08545   350.3 -0.3007214 0.9021643          ?        ? 
1 1 1   11    7   23 f 9.469446 3.966305   8.807926    26.7  0.4811543 1.263030          ?        ? 
1 1 1   11    8    0 o 674.3463 6.559016   774.0994   180.0   4552.351 88.44218   4552.351 88.44218 
1 1 1   11    8    1 o 392.6650 3.113170   502.5449    49.1   1542.400 24.44865          ?        ? 
1 1 1   11    8    2 o 23.96553 1.254808   65.21060   288.2   5.743780 0.6014429          ?        ? 
1 1 1   11    8    3 o 353.2257 2.545560   484.7067    73.1   1247.964 17.98314          ?        ? 
1 1 1   11    8    4 o 523.3652 3.548105   622.4650   354.1   2740.445 37.13910          ?        ? 
1 1 1   11    8    5 o 111.0092 0.9887772   150.2896   272.1   123.2356 2.195267          ?        ? 
1 1 1   11    8    6 o 323.8790 2.307322   380.2630    32.6   1049.247 14.94586          ?        ? 
1 1 1   11    8    7 o 338.6335 2.406599   352.7595    54.7   1147.132 16.29910          ?        ? 
1 1 1   11    8    8 o 282.9720 2.072314   340.3888   255.6   801.0317 11.72814          ?        ? 
1 1 1   11    8    9 o 60.69260 0.7927726   69.24392     1.9   36.83838 0.9623086          ?        ? 
1 1 1   11    8   10 o 238.0316 1.793983   237.5644   156.1   566.8900 8.540489          ?        ? 
1 1 1   11    8   11 o 201.0092 1.593302   236.2190    77.9   404.2599 6.405366          ?        ? 
1 1 1   11    8   12 o 163.0116 1.355918   177.8384   196.0   265.8678 4.420605          ?        ? 
1 1 1   11    8   13 o 60.65489 1.090740   80.07157   348.7   36.80830 1.323174          ?        ? 
1 1 1   11    8   14 o 129.9755 1.260955   162.5002   205.6   169.0656 3.277864          ?        ? 
1 1 1   11    8   15 o 130.5841 1.439310   159.2734   214.9   170.7196 3.759018          ?        ? 
1 1 1   11    8   16 o 60.31818 1.196540   52.59232   146.1   36.41737 1.443463          ?        ? 
1 1 1   11    8   17 o 119.9066 1.141124   128.4885   142.8   143.9554 2.736565          ?        ? 
1 1 1   11    8   18 o 72.75193 1.136718   63.00840    32.5   53.01719 1.653968          ?        ? 
1 1 1   11    8   19 o 34.45254 1.614786   51.41466   299.5   11.93864 1.112669          ?        ? 
1 1 1   11    8   20 o 38.56974 1.481397   43.44508   358.0   14.97593 1.142741          ?        ? 
1 1 1   11    8   21 o 13.12551 3.722870   17.68718    20.5   1.894545 1.022453          ?        ? 
1 1 1   11    8   22 o 31.47028 2.054482   31.44040   192.3   10.16438 1.293102          ?        ? 
1 1 1   11    8   23 o 14.97366 3.725903   18.53521   165.8   2.616277 1.112669          ?        ? 
1 1 1   11    9    0 o 927.4785 15.27102   1072.304     0.0   8643.847 283.0992   8643.847 283.0992 
1 1 1   11    9    1 o 86.98070 1.400221   190.9789    46.4   75.66151 2.435844          ?        ? 
1 1 1   11    9    2 o 59.94583 0.9782279   148.7120   341.4   35.93621 1.172814          ?        ? 
1 1 1   11    9    3 o 168.5353 1.382850   224.7904   221.9   284.0615 4.661182          ?        ? 
1 1 1   11    9    4 o 200.5793 1.626703   241.0874   166.5   402.3653 6.525656          ?        ? 
1 1 1   11    9    5 o 104.0744 1.025767   130.5455   345.2   108.3199 2.135122          ?        ? 
1 1 1   11    9    6 o 747.9420 5.403756   852.4673   292.3   5602.921 80.83392          ?        ? 
1 1 1   11    9    7 o 242.9363 1.652545   200.9191   300.6   590.2861 8.029263          ?        ? 
1 1 1   11    9    8 o 92.37884 0.8789330   114.3623   103.0   85.34474 1.623896          ?        ? 
1 1 1   11    9    9 o 281.6299 2.002106   287.0291   151.7   793.5137 11.27705          ?        ? 
1 1 1   11    9   10 o 174.8768 1.392892   235.8703   260.9   305.9239 4.871688          ?        ? 
1 1 1   11    9   11 o 222.0211 1.713408   282.4594   189.1   493.2734 7.608253          ?        ? 
1 1 1   11    9   12 o 89.60945 0.9732146   138.4329   214.2   80.32270 1.744184          ?        ? 
1 1 1   11    9   13 o 49.28392 0.9457816   64.44051    39.9   24.29829 0.9322364          ?        ? 
1 1 1   11    9   14 o 55.15366 0.9814374   76.31135    95.6   30.43301 1.082597          ?        ? 
1 1 1   11    9   15 o 51.18883 1.174950   35.00165   133.7   26.22291 1.202886          ?        ? 
1 1 1   11    9   16 f 15.32959 3.910274   20.44857   260.4   2.465916 1.202886          ?        ? 
1 1 1   11    9   17 o 114.7524 1.205481   129.9937    79.7   131.8663 2.766637          ?        ? 
1 1 1   11    9   18 o 67.13609 1.209406   74.91026   336.4   45.16836 1.623896          ?        ? 
1 1 1   11    9   19 o 34.79359 1.642172   39.43513   341.5   12.17922 1.142741          ?        ? 
1 1 1   11    9   20 o 59.82036 1.256769   67.77068   306.2   35.96629 1.503607          ?        ? 
1 1 1   11    9   21 o 14.97416 3.477663   14.06410   104.0   2.465916 1.022453          ?        ? 
1 1 1   11    9   22 o 25.24394 2.442086   27.27327    68.2   6.615872 1.232958          ?        ? 
1 1 1   11    9   23 o 16.50120 3.886668   14.71204   323.5   3.217719 1.263030          ?        ? 
1 1 1   11   10    0 o 154.5341 2.453328   62.83493     0.0   239.0134 7.578181   239.0134 7.578181 
1 1 1   11   10    1 o 460.2321 4.011953   595.2106   232.0   2119.334 36.92860          ?        ? 
1 1 1   11   10    2 o 224.9323 2.052206   323.1034   282.6   506.0240 9.232149          ?        ? 
1 1 1   11   10    3 o 258.2319 2.212627   261.0755   328.6   666.9701 11.42741          ?        ? 
1 1 1   11   10    4 o 203.9541 1.570296   264.2911   328.6   416.0181 6.405366          ?        ? 
1 1 1   11   10    5 o 559.4117 3.808664   710.4375   177.6   3131.563 42.61223          ?        ? 
1 1 1   11   10    6 o 202.7096 1.498343   259.8325   311.9   410.9659 6.074574          ?        ? 
1 1 1   11   10    7 o 167.8425 1.290016   149.4436    71.4   281.7459 4.330389          ?        ? 
1 1 1   11   10    8 o 97.64780 0.9084980   124.4092     7.8   95.35877 1.774257          ?        ? 
1 1 1   11   10    9 o 154.2749 1.198793   187.2356   272.7   238.0511 3.698874          ?        ? 
1 1 1   11   10   10 o 89.38051 0.9420623   99.88802   355.9   79.90170 1.684040          ?        ? 
1 1 1   11   10   11 o 47.80204 0.8807365   77.28384    41.1   22.85483 0.8420200          ?        ? 
1 1 1   11   10   12 o 56.42465 0.9326819   60.18732   148.1   31.84640 1.052525          ?        ? 
1 1 1   11   10   13 o 88.96538 0.9971613   104.4919    78.0   79.17995 1.774257          ?        ? 
1 1 1   11   10   14 o 27.12734 1.551977   23.13819   331.5   7.367675 0.8420200          ?        ? 
1 1 1   11   10   15 o 104.3867 1.109124   129.9503   254.6   109.0416 2.315555          ?        ? 
1 1 1   11   10   16 o 80.58197 1.044924   88.85709   348.3   64.98591 1.684040          ?        ? 
1 1 1   11   10   17 o 50.06239 1.381595   59.36908   292.8   25.11024 1.383319          ?        ? 
1 1 1   11   10   18 o 33.91172 1.640538   28.20339   303.5   11.54770 1.112669          ?        ? 
1 1 1   11   10   19 o 41.72514 1.513512   49.96337   250.5   17.50199 1.263030          ?        ? 
1 1 1   11   10   20 o 25.18057 2.089955   24.26850   339.9   6.435439 1.052525          ?        ? 
1 1 1   11   10   21 o 6.552330 3.083488   10.02920   349.9  -1.052525 1.052525          ?        ? 
1 1 1   11   10   22 o 23.00354 2.614567   29.04220   201.6   5.533275 1.202886          ?        ? 
1 1 1   11   10   23 o 11.22857 3.964088   12.47798   331.5   1.413391 1.112669          ?        ? 
1 1 1   11   11    0 f 449.2325 5.725554   347.8969   180.0   2020.337 51.42337   2020.337 51.42337 
1 1 1   11   11    1 o 286.1683 2.395950   320.1144   226.3   819.1051 13.71290          ?        ? 
1 1 1   11   11    2 o 170.0158 1.583063   139.4885   193.4   289.0835 5.382914          ?        ? 
1 1 1   11   11    3 o 549.2612 4.098051   603.7713   229.4   3019.093 45.01800          ?        ? 
1 1 1   11   11    4 o 107.7504 1.158227   98.72001   167.2   116.1086 2.495988          ?        ? 
1 1 1   11   11    5 o 372.0037 2.914221   467.9564    29.8   1384.491 21.68202          ?        ? 
1 1 1   11   11    6 o 93.97719 0.9279829   146.0758    45.5   88.32189 1.744184          ?        ? 
1 1 1   11   11    7 o 174.0398 1.347753   220.8824   153.0   302.9468 4.691255          ?        ? 
1 1 1   11   11    8 o 91.90514 0.8998235   83.65276   219.4   84.47266 1.653968          ?        ? 
1 1 1   11   11    9 o 160.6394 1.235538   174.0484   325.0   258.1092 3.969523          ?        ? 
1 1 1   11   11   10 o 169.4710 1.401833   245.5043   110.6   287.3093 4.751399          ?        ? 
1 1 1   11   11   11 o 83.35541 0.9380024   93.97988   342.8   69.49673 1.563751          ?        ? 
1 1 1   11   11   12 o 107.0781 1.011035   137.1950    26.2   114.6952 2.165194          ?        ? 
1 1 1   11   11   13 o 45.74043 0.9861783   41.05316   186.3   20.93021 0.9021643          ?        ? 
1 1 1   11   11   14 o 124.6926 1.121441   130.0101    62.0   155.5933 2.796710          ?        ? 
1 1 1   11   11   15 o 68.75635 1.005957   92.54271   244.7   47.30349 1.383319          ?        ? 
1 1 1   11   11   16 o 55.87204 1.076465   72.05905   301.7   31.24496 1.202886          ?        ? 
1 1 1   11   11   17 o 74.03796 1.035739   73.26311   270.6   54.88166 1.533679          ?        ? 
1 1 1   11   11   18 o 14.50494 3.940856   22.29115   176.2   2.225339 1.172814          ?        ? 
1 1 1   11   11   19 o 26.35561 1.882674   25.90417   190.8   7.006810 0.9923807          ?        ? 
1 1 1   11   11   20 o 45.34874 1.293105   43.97931    19.7   20.68964 1.172814          ?        ? 
1 1 1   11   11   21 o 56.06228 1.341015   60.95773    91.4   31.72611 1.503607          ?        ? 
1 1 1   11   11   22 f 7.905875 3.509340   9.374336   263.2 -0.2105050 1.112669          ?        ? 
1 1 1   11   11   23 o 7.484504 3.414165   11.34027   130.6 -0.4210100 1.142741          ?        ? 
1 1 1   11   12    0 o 218.3760 3.134305   163.7001    -0.0   477.2750 13.68283   477.2750 13.68283 
1 1 1   11   12    1 o 95.23218 1.231531   115.4401   213.4   90.69759 2.345627          ?        ? 
1 1 1   11   12    2 o 387.1081 3.165628   490.7459   355.0   1499.187 24.50880          ?        ? 
1 1 1   11   12    3 o 276.5960 2.364709   305.0927   108.5   765.2458 13.08138          ?        ? 
1 1 1   11   12    4 o 90.40504 1.147601   48.58151    67.0   81.73608 2.074978          ?        ? 
1 1 1   11   12    5 o 115.9235 1.115479   111.6316   340.5   134.3924 2.586205          ?        ? 
1 1 1   11   12    6 o 110.0267 1.161597   189.7550   138.0   121.0705 2.556132          ?        ? 
1 1 1   11   12    7 o 257.8916 1.784098   309.9391   323.7   665.2861 9.202076          ?        ? 
1 1 1   11   12    8 o 38.18838 0.9449621   60.62690    44.2   14.58499 0.7217315          ?        ? 
1 1 1   11   12    9 o 139.5467 1.152918   137.5422   158.1   194.7773 3.217719          ?        ? 
1 1 1   11   12   10 o 207.9667 1.619529   279.1733   188.4   432.7382 6.736160          ?        ? 
1 1 1   11   12   11 o 30.86906 1.217730   53.28346   354.8   9.532870 0.7518036          ?        ? 
1 1 1   11   12   12 o 138.8550 1.212805   185.9119   106.6   192.9128 3.368080          ?        ? 
1 1 1   11   12   13 o 103.1652 1.049383   101.3589    20.7   106.4855 2.165194          ?        ? 
1 1 1   11   12   14 o 45.63566 1.054338   48.98684    64.5   20.84000 0.9623086          ?        ? 
1 1 1   11   12   15 o 152.8698 1.327842   166.8886   118.2   233.9613 4.059740          ?        ? 
1 1 1   11   12   16 o 24.05335 1.937852   17.90297   187.3   5.803924 0.9322364          ?        ? 
1 1 1   11   12   17 o 35.36675 1.445500   41.87426   310.3   12.54008 1.022453          ?        ? 
1 1 1   11   12   18 o 7.799162 3.313207   5.419302   124.3       0.03 0.9021643          ?        ? 
1 1 1   11   12   19 o 20.75872 2.100544   20.00853   356.4   4.360461 0.8720922          ?        ? 
1 1 1   11   12   20 o 22.37005 2.419746   37.05104   333.3   5.112265 1.082597          ?        ? 
1 1 1   11   12   21 o 7.245566 3.348372   18.67967    23.8 -0.7818757 1.142741          ?        ? 
1 1 1   11   12   22 o 9.418451 3.777293   7.732353   358.8  0.6315150 1.082597          ?        ? 
1 1 1   11   12   23 o 15.74350 3.847548   13.46496    43.7   3.007215 1.202886          ?        ? 
1 1 1   11   13    0 o 476.0448 4.884259   551.7683   180.0   2268.101 46.49154   2268.101 46.49154 
1 1 1   11   13    1 o 170.3940 1.658968   215.5644   286.5   290.3766 5.653563          ?        ? 
1 1 1   11   13    2 o 215.6133 2.001432   267.8455   198.6   464.9755 8.630706          ?        ? 
1 1 1   11   13    3 o 319.2756 2.623154   345.1563   328.1   1019.716 16.75019          ?        ? 
1 1 1   11   13    4 f 298.8987 2.464940   269.5572    70.6   893.7141 14.73535          ?        ? 
1 1 1   11   13    5 o 338.9920 2.519378   367.4167    18.2   1149.628 17.08098          ?        ? 
1 1 1   11   13    6 f 151.6134 1.328928   177.5177     9.1   229.9016 4.029667          ?        ? 
1 1 1   11   13    7 o 378.9474 2.706075   440.4053   357.7   1437.088 20.50920          ?        ? 
1 1 1   11   13    8 o 28.70173 1.309683   45.57352   357.2   8.239767 0.7518036          ?        ? 
1 1 1   11   13    9 o 173.9035 1.357456   172.5235    91.1   302.5258 4.721327          ?        ? 
1 1 1   11   13   10 o 121.7030 1.161344   137.7752   329.9   148.1655 2.826782          ?        ? 
1 1 1   11   13   11 o 152.5999 1.330191   231.2052   359.1   232.9990 4.059740          ?        ? 
1 1 1   11   13   12 o 102.0993 1.030883   106.1910   336.3   104.2902 2.105050          ?        ? 
1 1 1   11   13   13 o 82.94930 0.9425948   82.31639   354.3   68.83514 1.563751          ?        ? 
1 1 1   11   13   14 o 81.14939 0.9820307   82.38332   104.7   65.88807 1.593824          ?        ? 
1 1 1   11   13   15 o 28.20422 1.652654   25.88848   342.4   7.969118 0.9322364          ?        ? 
1 1 1   11   13   16 o 62.15356 1.088632   72.92279   239.2   38.67278 1.353247          ?        ? 
1 1 1   11   13   17 o 14.72538 3.430218   23.81225   324.2   2.285483 0.9923807          ?        ? 
1 1 1   11   13   18 o 63.29068 1.045315   71.82299   341.2   40.14631 1.323174          ?        ? 
1 1 1   11   13   19 o 44.58125 1.281639   38.51094   317.3   19.96791 1.142741          ?        ? 
1 1 1   11   13   20 o 46.50739 1.163898   62.29848    46.7   21.74216 1.082597          ?        ? 
1 1 1   11   13   21 o 16.64686 3.457289   19.72256   149.8   3.067359 1.112669          ?        ? 
1 1 1   11   13   22 o 17.21996 3.686882   14.33707   124.2   3.398152 1.232958          ?        ? 
1 1 1   11   13   23 f 17.02917 3.559136   19.53479   228.0   3.428224 1.172814          ?        ? 
1 1 1   11   14    0 o 16.08992 4.227737   8.724365   360.0   3.067359 1.172814   3.067359 1.172814 
1 1 1   11   14    1 o 244.6808 1.941877   260.5555    90.4   598.7965 9.502798          ?        ? 
1 1 1   11   14    2 o 406.0117 3.266363   344.5467   229.4   1649.367 26.52363          ?        ? 
1 1 1   11   14    3 o 239.2562 2.055034   291.1902   121.4   572.5736 9.833591          ?        ? 
1 1 1   11   14    4 o 266.0773 2.107829   306.2462   230.2   708.1689 11.21691          ?        ? 
1 1 1   11   14    5 o 122.8231 1.199722   139.2267   349.0   150.8719 2.947070          ?        ? 
1 1 1   11   14    6 o 293.1445 2.169667   282.3539   163.0   859.7325 12.72052          ?        ? 
1 1 1   11   14    7 o 266.2634 2.021650   258.5213    78.4   709.2816 10.76583          ?        ? 
1 1 1   11   14    8 o 121.0281 1.192668   191.7053   177.1   146.5115 2.886926          ?        ? 
1 1 1   11   14    9 o 43.55680 1.001098   62.87477   243.8   18.97552 0.8720922          ?        ? 
1 1 1   11   14   10 o 130.1770 1.143497   125.1113   140.9   169.5167 2.977142          ?        ? 
1 1 1   11   14   11 o 153.7963 1.329619   144.6861   235.3   236.6678 4.089812          ?        ? 
1 1 1   11   14   12 o 77.98293 0.9640617   114.3985   352.4   60.83595 1.503607          ?        ? 
1 1 1   11   14   13 o 18.00126 2.171725   29.11710   298.6   3.247792 0.7818757          ?        ? 
1 1 1   11   14   14 o 77.95727 0.9836667   108.5997   295.2   60.80587 1.533679          ?        ? 
1 1 1   11   14   15 o 28.67579 1.730346   42.64624   188.0   8.239767 0.9923807          ?        ? 
1 1 1   11   14   16 o 128.4799 1.217117   135.4592   172.1   165.3066 3.127503          ?        ? 
1 1 1   11   14   17 o 44.02751 1.297759   47.92051   299.9   19.42661 1.142741          ?        ? 
1 1 1   11   14   18 o 38.73594 1.358590   39.20260   181.6   15.06614 1.052525          ?        ? 
1 1 1   11   14   19 o 86.42940 1.165595   93.25233   355.0   74.99992 2.014834          ?        ? 
1 1 1   11   14   20 o 29.38577 1.739707   32.47382    48.6   8.750995 1.022453          ?        ? 
1 1 1   11   14   21 o 20.08824 2.395204   23.27041   156.1   4.180028 0.9623086          ?        ? 
1 1 1   11   14   22 o 30.03475 2.052552   28.67690   212.1   9.352437 1.232958          ?        ? 
1 1 1   11   14   23 o 21.72903 2.837122   27.23968   240.6   5.202481 1.232958          ?        ? 
1 1 1   11   15    0 o 145.6211 1.931626   30.72705   180.0   212.1890 5.623491   212.1890 5.623491 
1 1 1   11   15    1 o 295.1502 2.307754   337.3989   180.6   871.4005 13.62268          ?        ? 
1 1 1   11   15    2 f 71.83296 1.151260   97.62086    19.9   51.60380 1.653968          ?        ? 
1 1 1   11   15    3 o 105.1496 1.244073   51.13111   102.3   110.5753 2.616277          ?        ? 
1 1 1   11   15    4 o 205.2729 1.699381   153.0719    40.8   421.4611 6.976738          ?        ? 
1 1 1   11   15    5 o 176.1223 1.476951   226.7967   183.9   310.2543 5.202481          ?        ? 
1 1 1   11   15    6 o 104.7895 1.147907   139.6850     8.1   109.8235 2.405771          ?        ? 
1 1 1   11   15    7 o 195.1236 1.618244   226.3754   286.9   380.8637 6.315150          ?        ? 
1 1 1   11   15    8 o 148.9696 1.352514   142.9695   339.3   221.9926 4.029667          ?        ? 
1 1 1   11   15    9 o 219.7010 1.909443   234.8774   342.6   483.0789 8.390128          ?        ? 
1 1 1   11   15   10 o 160.4530 1.274458   198.1580    16.7   257.5679 4.089812          ?        ? 
1 1 1   11   15   11 o 74.47505 0.9489021   75.67362    45.9   55.48311 1.413391          ?        ? 
1 1 1   11   15   12 o 39.53388 1.102968   53.73463   198.9   15.63752 0.8720922          ?        ? 
1 1 1   11   15   13 o 6.675114 2.870268   4.263893   214.7      -0.06 0.6916593          ?        ? 
1 1 1   11   15   14 o 110.6807 1.181903   90.94203   348.4   122.6041 2.616277          ?        ? 
1 1 1   11   15   15 o 111.5501 1.159212   107.7832    41.9   124.5588 2.586205          ?        ? 
1 1 1   11   15   16 o 110.9225 1.165771   122.4023   249.0   123.2056 2.586205          ?        ? 
1 1 1   11   15   17 o 38.52392 1.405097   55.30697   309.8   14.88571 1.082597          ?        ? 
1 1 1   11   15   18 o 8.144943 3.439091   14.61083   184.8       0.09 0.9623086          ?        ? 
1 1 1   11   15   19 o 43.15076 1.393818   32.21730   346.9   18.73495 1.202886          ?        ? 
1 1 1   11   15   20 o 32.63351 1.658720   45.19884    90.5   10.79590 1.082597          ?        ? 
1 1 1   11   15   21 o 17.29801 2.694635   17.65263    86.4   3.127503 0.9322364          ?        ? 
1 1 1   11   15   22 o 23.43761 2.245377   21.46521   136.0   5.743780 1.052525          ?        ? 
1 1 1   11   16    0 o 106.7921 2.240880   45.14831   360.0   114.2140 4.781471   114.2140 4.781471 
1 1 1   11   16    1 o 407.9635 2.966942   391.5988    53.9   1665.275 24.20808          ?        ? 
1 1 1   11   16    2 o 53.47538 1.124710   60.40311   262.2   28.59861 1.202886          ?        ? 
1 1 1   11   16    3 o 214.9110 1.910022   265.5785   293.3   461.9984 8.209695          ?        ? 
1 1 1   11   16    4 o 329.0414 2.517882   349.9173   284.5   1083.319 16.56975          ?        ? 
1 1 1   11   16    5 o 294.3288 2.247782   355.0333    47.2   866.7393 13.23174          ?        ? 
1 1 1   11   16    6 o 103.4026 1.119680   83.91248   244.7   106.9365 2.315555          ?        ? 
1 1 1   11   16    7 o 120.3788 1.249063   174.9258   334.0   144.9477 3.007215          ?        ? 
1 1 1   11   16    8 o 80.02529 1.052192   98.79548     1.3   64.05367 1.684040          ?        ? 
1 1 1   11   16    9 o 104.9342 1.232298   120.8472   342.3   110.1543 2.586205          ?        ? 
1 1 1   11   16   10 o 86.81268 1.039208   91.58754   256.4   75.39087 1.804329          ?        ? 
1 1 1   11   16   11 o 40.87811 1.177047   45.96704    34.1   16.72011 0.9623086          ?        ? 
1 1 1   11   16   12 o 74.34587 1.051674   72.21001   231.4   55.30267 1.563751          ?        ? 
1 1 1   11   16   13 f 37.29587 1.290101   25.47581   263.8   13.92340 0.9623086          ?        ? 
1 1 1   11   16   14 o 83.49800 1.026439   92.56674   171.5   69.76737 1.714112          ?        ? 
1 1 1   11   16   15 o 95.94102 1.112727   99.39761   191.7   92.14105 2.135122          ?        ? 
1 1 1   11   16   16 o 27.80207 1.784725   51.71597   210.2   7.758613 0.9923807          ?        ? 
1 1 1   11   16   17 o 16.12749 3.283879   25.74908    50.2   2.736565 1.022453          ?        ? 
1 1 1   11   16   18 f 13.73023 3.656905   34.19283   345.3   2.014834 1.022453          ?        ? 
1 1 1   11   16   19 o 14.47260 3.293746   12.86527    39.6   2.255411 0.9322364          ?        ? 
1 1 1   11   16   20 o 29.44883 1.940215   30.75744   208.9   8.841210 1.142741          ?        ? 
1 1 1   11   16   21 o 16.96914 3.217934   24.19672   182.0   3.157575 1.052525          ?        ? 
1 1 1   11   16   22 o 17.93323 2.934566   17.87890   292.3   3.488369 1.052525          ?        ? 
1 1 1   11   17    0 o 349.7809 3.826881   402.1847     0.0   1224.598 26.76421   1224.598 26.76421 
1 1 1   11   17    1 o 70.69316 1.084744   84.52473     7.2   49.97990 1.533679          ?        ? 
1 1 1   11   17    2 o 245.3881 1.917897   251.4297    86.3   602.3450 9.412581          ?        ? 
1 1 1   11   17    3 o 124.7532 1.157055   61.22771   352.1   155.6534 2.886926          ?        ? 
1 1 1   11   17    4 o 187.0695 1.591464   195.5051   118.0   350.0398 5.954284          ?        ? 
1 1 1   11   17    5 o 205.7427 1.753966   201.7641   114.6   423.4459 7.217315          ?        ? 
1 1 1   11   17    6 o 260.1736 2.028515   220.6264    53.9   677.3149 10.55532          ?        ? 
1 1 1   11   17    7 o 206.8501 1.744576   244.6792   196.3   428.1071 7.217315          ?        ? 
1 1 1   11   17    8 o 113.8940 1.214566   156.9204   311.9   129.7613 2.766637          ?        ? 
1 1 1   11   17    9 o 200.6251 1.866159   248.8454   291.8   402.8765 7.487964          ?        ? 
1 1 1   11   17   10 o 65.15131 1.038541   47.14277    98.4   42.46187 1.353247          ?        ? 
1 1 1   11   17   11 o 108.5396 1.260629   120.4901   196.4   117.8828 2.736565          ?        ? 
1 1 1   11   17   12 o 49.40099 1.095724   58.18021    38.5   24.41858 1.082597          ?        ? 
1 1 1   11   17   13 o 83.84232 1.058091   85.19538   110.6   70.33875 1.774257          ?        ? 
1 1 1   11   17   14 o 21.83777 1.996753   36.36752   284.7   4.781471 0.8720922          ?        ? 
1 1 1   11   17   15 o 80.45947 1.065202   87.49870    43.9   64.80547 1.714112          ?        ? 
1 1 1   11   17   16 o 51.92206 1.187316   69.48932   344.1   27.00479 1.232958          ?        ? 
1 1 1   11   17   17 o 23.22604 2.201092   20.92237   354.0   5.443058 1.022453          ?        ? 
1 1 1   11   17   18 o 27.77182 1.894952   25.33465   316.5   7.788685 1.052525          ?        ? 
1 1 1   11   17   19 o 25.68678 2.107304   25.39937    77.7   6.706088 1.082597          ?        ? 
1 1 1   11   17   20 o 23.25410 2.521735   23.35061   132.0   5.593419 1.172814          ?        ? 
1 1 1   11   17   21 o 8.672229 3.654032   4.835876   106.8  0.2706493 1.082597          ?        ? 
1 1 1   11   17   22 o 12.36059 3.973053   19.00005   315.4   1.834401 1.112669          ?        ? 
1 1 1   11   18    0 o 31.94242 2.379913   90.59438    -0.0   10.37489 1.503607   10.37489 1.503607 
1 1 1   11   18    1 o 114.1421 1.211927   81.10685    11.9   130.3026 2.766637          ?        ? 
1 1 1   11   18    2 o 408.2818 3.060380   436.8742   193.3   1668.493 24.98995          ?        ? 
1 1 1   11   18    3 o 246.1186 1.832784   293.4551   344.6   605.9537 9.021644          ?        ? 
1 1 1   11   18    4 o 87.08239 1.001456   90.44042   196.2   75.84195 1.744184          ?        ? 
1 1 1   11   18    5 f 40.18169 1.160027   100.6170   184.9   16.14874 0.9322364          ?        ? 
1 1 1   11   18    6 o 57.58745 1.044399   67.31164   160.1   33.16957 1.202886          ?        ? 
1 1 1   11   18    7 f 76.05689 1.047784   115.2271   140.6   57.85880 1.593824          ?        ? 
1 1 1   11   18    8 o 92.54760 1.072292   109.0608   291.1   85.67554 1.984761          ?        ? 
1 1 1   11   18    9 o 24.32708 1.792431   13.79255   265.6   5.924213 0.8720922          ?        ? 
1 1 1   11   18   10 o 61.63982 1.024525   56.24124   329.2   38.01119 1.263030          ?        ? 
1 1 1   11   18   11 f 55.47546 1.138368   58.75607   219.6   30.79388 1.263030          ?        ? 
1 1 1   11   18   12 o 123.8290 1.299259   119.8836   275.0   153.4882 3.217719          ?        ? 
1 1 1   11   18   13 o 13.66601 3.416496   18.76584   215.5   1.954689 0.9322364          ?        ? 
1 1 1   11   18   14 o 30.15826 1.595431   27.93800    90.4   9.111859 0.9623086          ?        ? 
1 1 1   11   18   15 o 28.55574 1.790276   39.39194    88.0   8.179624 1.022453          ?        ? 
1 1 1   11   18   16 o 45.69429 1.349138   57.99533    60.2   20.93021 1.232958          ?        ? 
1 1 1   11   18   17 o 27.41065 1.974774   31.59176   343.1   7.578181 1.082597          ?        ? 
1 1 1   11   18   18 o 36.09219 1.499766   36.01118   264.0   13.11145 1.082597          ?        ? 
1 1 1   11   18   19 o 17.67403 3.178373   17.43125   228.9   3.338008 1.082597          ?        ? 
1 1 1   11   18   20 o 13.59197 3.751353   9.031675   267.9   2.074978 1.052525          ?        ? 
1 1 1   11   18   21 o 26.44777 2.103522   25.06949   259.3   7.247387 1.112669          ?        ? 
1 1 1   11   18   22 f 28.65990 2.203479   34.94525   159.4   8.690849 1.263030          ?        ? 
1 1 1   11   19    0 f 122.7160 1.851107   142.5363    -0.0   150.7216 4.540894   150.7216 4.540894 
1 1 1   11   19    1 o 157.7480 1.553668   151.1300   109.7   248.9072 4.901759          ?        ? 
1 1 1   11   19    2 o 161.9903 1.466569   141.1144   347.6   262.4697 4.751399          ?        ? 
1 1 1   11   19    3 o 181.9520 1.504004   136.8637   189.9   331.1544 5.473131          ?        ? 
1 1 1   11   19    4 o 74.94502 0.9429517   90.83530   322.0   56.17477 1.413391          ?        ? 
1 1 1   11   19    5 o 21.86044 1.788335   30.45976   283.4   4.781471 0.7818757          ?        ? 
1 1 1   11   19    6 o 194.1354 1.641971   201.9902   198.7   377.0746 6.375295          ?        ? 
1 1 1   11   19    7 o 53.49786 1.096131   47.64321    74.0   28.62868 1.172814          ?        ? 
1 1 1   11   19    8 o 57.40122 1.047788   61.83344   108.6   32.95907 1.202886          ?        ? 
1 1 1   11   19    9 o 72.09458 1.042802   105.6045   139.7   51.99474 1.503607          ?        ? 
1 1 1   11   19   10 o 98.57535 1.159257   121.4941   297.4   97.22324 2.285483          ?        ? 
1 1 1   11   19   11 o 61.22116 1.056091   71.42489    70.9   37.49996 1.293102          ?        ? 
1 1 1   11   19   12 o 86.48121 1.182283   94.96626   358.6   74.84956 2.044906          ?        ? 
1 1 1   11   19   13 o 22.10759 2.108408   19.93502   222.3   4.901759 0.9322364          ?        ? 
1 1 1   11   19   14 o 47.08147 1.213579   32.56608   198.1   22.19324 1.142741          ?        ? 
1 1 1   11   19   15 o 40.88741 1.323876   53.37411   236.4   16.75019 1.082597          ?        ? 
1 1 1   11   19   16 o 29.71308 1.771148   37.33252   267.1   8.871283 1.052525          ?        ? 
1 1 1   11   19   17 o 52.93224 1.249876   50.35342   253.6   28.11745 1.323174          ?        ? 
1 1 1   11   19   18 o 33.21039 1.675183   35.63082   331.6   11.12669 1.112669          ?        ? 
1 1 1   11   19   19 o 25.07160 2.218984   19.87819    82.9   6.435439 1.112669          ?        ? 
1 1 1   11   19   20 o 7.997205 3.464868   6.977407    31.5   0.000000 1.022453          ?        ? 
1 1 1   11   19   21 o 8.388829 3.624239   6.102734    12.1  0.1202886 1.112669          ?        ? 
1 1 1   11   19   22 o 12.22432 4.082779   11.39903   253.8   1.834401 1.172814          ?        ? 
1 1 1   11   20    0 o 72.56060 1.701289   59.64331   180.0   52.74654 2.465916   52.74654 2.465916 
1 1 1   11   20    1 o 295.7832 2.297732   264.9710   305.5   875.4603 13.59261          ?        ? 
1 1 1   11   20    2 o 95.24352 1.073514   70.54501   127.4   90.72766 2.044906          ?        ? 
1 1 1   11   20    3 o 226.1293 1.735474   246.1266   197.8   511.5873 7.848830          ?        ? 
1 1 1   11   20    4 o 115.3294 1.134263   140.8545   336.9   133.0392 2.616277          ?        ? 
1 1 1   11   20    5 o 183.0601 1.470258   197.2491   239.0   335.2443 5.382914          ?        ? 
1 1 1   11   20    6 o 107.0680 1.053261   154.0978   149.5   114.6651 2.255411          ?        ? 
1 1 1   11   20    7 o 146.4262 1.530037   163.3424   270.1   214.5347 4.480750          ?        ? 
1 1 1   11   20    8 o 74.91599 1.063741   89.14030   154.8   56.14469 1.593824          ?        ? 
1 1 1   11   20    9 o 158.8351 1.467302   189.1545   183.3   252.5158 4.661182          ?        ? 
1 1 1   11   20   10 o 17.22733 2.618410   13.86794   258.8   2.977142 0.9021643          ?        ? 
1 1 1   11   20   11 o 63.10419 1.048405   58.54684    82.4   39.84559 1.323174          ?        ? 
1 1 1   11   20   12 o 100.9169 1.340951   88.67978   100.5   101.9446 2.706493          ?        ? 
1 1 1   11   20   13 o 84.25456 1.231374   99.09515   111.0   71.06048 2.074978          ?        ? 
1 1 1   11   20   14 o 82.97555 1.087265   88.36514   348.0   68.92535 1.804329          ?        ? 
1 1 1   11   20   15 o 55.41498 1.221012   66.23529    78.1   30.76381 1.353247          ?        ? 
1 1 1   11   20   16 o 28.36506 1.802311   32.91793    15.3   8.089407 1.022453          ?        ? 
1 1 1   11   20   17 o 21.43564 2.384938   30.73162    79.5   4.661182 1.022453          ?        ? 
1 1 1   11   20   18 o 35.35729 1.701043   34.56849   118.0   12.63030 1.202886          ?        ? 
1 1 1   11   20   19 o 15.20157 3.609806   17.83536   142.1   2.556132 1.082597          ?        ? 
1 1 1   11   20   20 o 21.02643 2.717394   18.32093   162.2   4.631110 1.142741          ?        ? 
1 1 1   11   20   21 o 13.64778 3.887692   9.482693   168.1   2.195267 1.112669          ?        ? 
1 1 1   11   21    0 o 182.9819 2.285193   94.94061   180.0   335.1240 8.360056   335.1240 8.360056 
1 1 1   11   21    1 o 134.6296 1.329049   154.0921   215.5   181.3050 3.578585          ?        ? 
1 1 1   11   21    2 o 143.9838 1.326247   182.1589   199.5   207.3775 3.819162          ?        ? 
1 1 1   11   21    3 o 158.8139 1.372821   160.7275   244.6   252.3053 4.360461          ?        ? 
1 1 1   11   21    4 o 163.6895 1.341117   187.1275   182.0   268.0330 4.390533          ?        ? 
1 1 1   11   21    5 o 164.8081 1.350261   159.2594    83.1   271.7319 4.450677          ?        ? 
1 1 1   11   21    6 o 85.77213 0.9816942   88.25779   285.3   73.58654 1.684040          ?        ? 
1 1 1   11   21    7 o 172.8686 1.556938   230.7662    51.7   299.0675 5.382914          ?        ? 
1 1 1   11   21    8 o 154.9512 1.436155   152.4305   169.3   240.2764 4.450677          ?        ? 
1 1 1   11   21    9 o 126.7965 1.328144   118.0210   194.4   160.8860 3.368080          ?        ? 
1 1 1   11   21   10 o 100.0094 1.142635   119.7645    24.8   100.0801 2.285483          ?        ? 
1 1 1   11   21   11 o 134.0118 1.312735   136.0362   224.6   179.7713 3.518441          ?        ? 
1 1 1   11   21   12 o 83.34007 1.262928   80.90127   242.2   69.52679 2.105050          ?        ? 
1 1 1   11   21   13 o 42.65218 1.515869   68.76350   180.8   18.22372 1.293102          ?        ? 
1 1 1   11   21   14 o 76.06847 1.225523   64.85088    99.8   57.94902 1.864473          ?        ? 
1 1 1   11   21   15 o 14.01807 3.450949   7.113496   115.7   2.074978 0.9623086          ?        ? 
1 1 1   11   21   16 o 9.104931 3.662840   19.12490    19.1  0.4210100 1.022453          ?        ? 
1 1 1   11   21   17 o 58.59315 1.283091   57.92599   143.6   34.49275 1.503607          ?        ? 
1 1 1   11   21   18 o 50.12775 1.319802   44.61895   158.4   25.29067 1.323174          ?        ? 
1 1 1   11   21   19 o 14.02586 3.775342   21.81026   132.8   2.195267 1.082597          ?        ? 
1 1 1   11   21   20 o 9.631218 3.935105   15.27765   230.6  0.5713707 1.202886          ?        ? 
1 1 1   11   21   21 o 6.552344 3.097357   5.959717   270.9 -0.9923807 1.082597          ?        ? 
1 1 1   11   22    0 o 221.4433 2.574203   344.3433   180.0   490.8676 11.39734   490.8676 11.39734 
1 1 1   11   22    1 o 45.07969 1.367532   58.61686   116.7   20.32877 1.232958          ?        ? 
1 1 1   11   22    2 o 100.0441 1.082120   54.48888   189.0   100.1102 2.165194          ?        ? 
1 1 1   11   22    3 f 87.81677 1.044448   112.0763   298.0   77.13505 1.834401          ?        ? 
1 1 1   11   22    4 o 34.58863 1.304134   47.83395   119.0   11.96871 0.9021643          ?        ? 
1 1 1   11   22    5 o 84.05331 1.055435   72.68612    91.6   70.66954 1.774257          ?        ? 
1 1 1   11   22    6 o 82.55529 0.9653068   99.32852   325.5   68.17355 1.593824          ?        ? 
1 1 1   11   22    7 f 77.22837 1.031890   92.78040   286.1   59.66313 1.593824          ?        ? 
1 1 1   11   22    8 o 75.65303 0.9937522   95.86916   111.7   57.25736 1.503607          ?        ? 
1 1 1   11   22    9 o 152.1772 1.393169   148.6031    17.6   231.7961 4.240172          ?        ? 
1 1 1   11   22   10 o 95.21501 1.152794   119.1892    78.3   90.72766 2.195267          ?        ? 
1 1 1   11   22   11 o 107.2608 1.233605   99.32047   120.8   115.1462 2.646349          ?        ? 
1 1 1   11   22   12 o 100.3750 1.288272   135.3745    53.3   100.8620 2.586205          ?        ? 
1 1 1   11   22   13 f 55.66390 1.350613   76.43391    31.2   31.03445 1.503607          ?        ? 
1 1 1   11   22   14 o 87.60768 1.252896   88.80585   217.2   76.89447 2.195267          ?        ? 
1 1 1   11   22   15 o 20.77985 2.532562   31.28595   231.4   4.360461 1.052525          ?        ? 
1 1 1   11   22   16 o 21.01922 2.503720   29.56180   180.4   4.480750 1.052525          ?        ? 
1 1 1   11   22   17 o 30.08668 1.799130   29.77350    19.3   9.141932 1.082597          ?        ? 
1 1 1   11   22   18 f 40.53396 1.520895   46.49958   356.5   16.59982 1.232958          ?        ? 
1 1 1   11   22   19 o 21.58110 2.508207   19.23985   111.1   4.841615 1.082597          ?        ? 
1 1 1   11   22   20 o 14.37328 3.883271   21.75504   209.9   2.405771 1.142741          ?        ? 
1 1 1   11   22   21 o 35.48944 1.906549   43.29262    28.0   13.14153 1.353247          ?        ? 
1 1 1   11   23    0 o 9.140645 5.047370   49.67597    -0.0   1.172814 1.323174   1.172814 1.323174 
1 1 1   11   23    1 o 49.55876 1.213596   44.05172    25.0   24.56894 1.202886          ?        ? 
1 1 1   11   23    2 o 175.0400 1.486083   198.7843   351.4   306.5555 5.202481          ?        ? 
1 1 1   11   23    3 o 150.6758 1.337198   169.1644    99.1   227.1349 4.029667          ?        ? 
1 1 1   11   23    4 o 89.47559 1.058694   77.39111   329.8   80.08212 1.894545          ?        ? 
1 1 1   11   23    5 o 75.77637 0.9722919   95.19162   338.2   57.43780 1.473535          ?        ? 
1 1 1   11   23    6 o 64.59509 1.047484   56.79717   192.0   41.74014 1.353247          ?        ? 
1 1 1   11   23    7 o 99.60892 1.071753   102.5285   156.0   99.26815 2.135122          ?        ? 
1 1 1   11   23    8 o 111.4418 1.092877   96.26818   153.9   124.2581 2.435844          ?        ? 
1 1 1   11   23    9 o 75.19204 0.9998447   81.46574   230.4   56.56570 1.503607          ?        ? 
1 1 1   11   23   10 o 109.0937 1.226662   107.3260   177.0   119.1158 2.676421          ?        ? 
1 1 1   11   23   11 o 113.9582 1.279854   109.9501   269.3   130.0019 2.916998          ?        ? 
1 1 1   11   23   12 o 35.62436 1.772705   37.96149   162.0   12.72052 1.263030          ?        ? 
1 1 1   11   23   13 o 81.04609 1.335780   87.50655   195.5   65.79785 2.165194          ?        ? 
1 1 1   11   23   14 o 50.25741 1.436070   55.71645   183.0   25.32075 1.443463          ?        ? 
1 1 1   11   23   15 o 24.57258 2.447618   32.18968   207.5   6.104645 1.202886          ?        ? 
1 1 1   11   23   16 o 55.16787 1.226480   59.34733   140.9   30.55330 1.353247          ?        ? 
1 1 1   11   23   17 o 34.48090 1.613457   36.35713   336.7   11.99879 1.112669          ?        ? 
1 1 1   11   23   18 o 42.26895 1.387323   51.74763    41.3   18.04329 1.172814          ?        ? 
1 1 1   11   23   19 o 27.11986 2.051393   18.98548   275.9   7.548109 1.112669          ?        ? 
1 1 1   11   23   20 o 26.02995 2.310580   25.47789   292.2   7.097026 1.202886          ?        ? 
1 1 1   11   23   21 o 8.574928 3.737133   7.918561   320.8  0.2105050 1.202886          ?        ? 
1 1 1   11   24    0 o 29.32044 2.443035   55.93379    -0.0   8.781067 1.413391   8.781067 1.413391 
1 1 1   11   24    1 o 149.0382 1.392246   192.1676   266.7   222.2332 4.149956          ?        ? 
1 1 1   11   24    2 o 86.71085 1.075109   117.1933   343.7   75.21043 1.864473          ?        ? 
1 1 1   11   24    3 o 104.0435 1.112782   115.7756    94.4   108.2898 2.315555          ?        ? 
1 1 1   11   24    4 o 8.706387 3.331210   25.55059   157.1  0.5112265 0.8119479          ?        ? 
1 1 1   11   24    5 o 170.7029 1.382908   183.8461    88.8   291.5795 4.721327          ?        ? 
1 1 1   11   24    6 o 105.4559 1.097878   130.3229    54.5   111.2669 2.315555          ?        ? 
1 1 1   11   24    7 o 92.32750 1.074849   105.6489     6.2   85.28461 1.984761          ?        ? 
1 1 1   11   24    8 o 105.0684 1.087617   117.8921   148.1   110.4550 2.285483          ?        ? 
1 1 1   11   24    9 o 47.53597 1.138714   83.37125   249.2   22.61425 1.082597          ?        ? 
1 1 1   11   24   10 o 48.25681 1.184021   36.04008   272.6   23.30591 1.142741          ?        ? 
1 1 1   11   24   11 o 69.69899 1.208081   76.12426   347.6   48.62666 1.684040          ?        ? 
1 1 1   11   24   12 o 23.76724 2.657082   29.08711   118.0   5.683635 1.263030          ?        ? 
1 1 1   11   24   13 o 37.16066 1.861268   48.66547     7.6   13.86326 1.383319          ?        ? 
1 1 1   11   24   14 o 71.57829 1.281395   80.67287   120.9   51.36322 1.834401          ?        ? 
1 1 1   11   24   15 o 14.98473 3.804703   24.52250    26.0   2.405771 1.142741          ?        ? 
1 1 1   11   24   16 o 36.68533 1.639465   42.22340   286.3   13.56254 1.202886          ?        ? 
1 1 1   11   24   17 o 8.119881 3.516699   3.236281    60.0      -0.06 1.052525          ?        ? 
1 1 1   11   24   18 o 13.27379 3.781160   13.99730   160.0   1.954689 1.052525          ?        ? 
1 1 1   11   24   19 o 22.09060 2.450357   23.58220   136.1   5.082192 1.082597          ?        ? 
1 1 1   11   24   20 o 14.20418 3.903772   11.74619   320.3   2.405771 1.142741          ?        ? 
1 1 1   11   25    0 o 182.4321 2.391104   248.9608    -0.0   333.2896 8.720922   333.2896 8.720922 
1 1 1   11   25    1 o 133.4613 1.239286   149.3709   341.0   178.2075 3.307936          ?        ? 
1 1 1   11   25    2 o 89.70779 1.039192   72.80131   302.9   80.50314 1.864473          ?        ? 
1 1 1   11   25    3 o 75.87389 1.030494   85.11279   282.1   57.58816 1.563751          ?        ? 
1 1 1   11   25    4 o 51.69405 1.076206   73.16483   311.2   26.73414 1.112669          ?        ? 
1 1 1   11   25    5 o 103.9324 1.142906   119.5925    12.6   108.0793 2.375700          ?        ? 
1 1 1   11   25    6 o 52.58593 1.086547   64.00524   198.5   27.66637 1.142741          ?        ? 
1 1 1   11   25    7 o 39.37613 1.298316   46.90133   120.5   15.51723 1.022453          ?        ? 
1 1 1   11   25    8 o 56.67974 1.061125   72.19349   342.0   32.14712 1.202886          ?        ? 
1 1 1   11   25    9 o 105.9876 1.106557   117.8719   272.5   112.4097 2.345627          ?        ? 
1 1 1   11   25   10 o 73.76800 1.100678   74.91666   204.8   54.46066 1.623896          ?        ? 
1 1 1   11   25   11 o 66.13890 1.113970   60.12328   202.7   43.78505 1.473535          ?        ? 
1 1 1   11   25   12 f 15.98390 3.310076   10.67864   131.6   2.676421 1.022453          ?        ? 
1 1 1   11   25   13 o 69.33600 1.322834   55.68996   237.8   48.17558 1.834401          ?        ? 
1 1 1   11   25   14 o 33.86512 2.042394   40.42345   211.3   11.54770 1.383319          ?        ? 
1 1 1   11   25   15 o 42.06351 1.608575   52.70327   210.9   17.80271 1.353247          ?        ? 
1 1 1   11   25   16 o 35.84694 1.845589   35.97357   313.4   12.99117 1.323174          ?        ? 
1 1 1   11   25   17 o 26.48047 2.100924   26.45262    48.3   7.157170 1.112669          ?        ? 
1 1 1   11   25   18 o 19.01311 2.767893   14.94530   267.0   3.789090 1.052525          ?        ? 
1 1 1   11   25   19 o 19.74296 2.817888   15.90328   178.7   4.149956 1.112669          ?        ? 
1 1 1   11   25   20 o 8.006092 3.466739   9.646020    34.7  0.1503607 1.022453          ?        ? 
1 1 1   11   26    0 o 123.0694 1.858017   93.05855   180.0   151.6538 4.570966   151.6538 4.570966 
1 1 1   11   26    1 o 136.7252 1.297681   125.6421   153.2   187.0487 3.548513          ?        ? 
1 1 1   11   26    2 o 52.84357 1.081249   66.04153   313.9   27.93702 1.142741          ?        ? 
1 1 1   11   26    3 o 177.4400 1.432087   155.8823    36.9   315.1260 5.082192          ?        ? 
1 1 1   11   26    4 f 82.12939 1.043544   81.56009    90.4   67.48189 1.714112          ?        ? 
1 1 1   11   26    5 o 66.87633 1.079203   91.05866   320.0   44.74735 1.443463          ?        ? 
1 1 1   11   26    6 o 155.8696 1.350520   150.6082    85.6   243.1634 4.210100          ?        ? 
1 1 1   11   26    7 o 57.70375 1.094409   52.64259    56.8   33.31994 1.263030          ?        ? 
1 1 1   11   26    8 o 125.9743 1.145839   137.1865    37.2   158.8110 2.886926          ?        ? 
1 1 1   11   26    9 o 88.32125 1.106579   94.69191    26.9   78.06729 1.954689          ?        ? 
1 1 1   11   26   10 o 164.1703 1.419618   163.8021    58.5   269.8975 4.661182          ?        ? 
1 1 1   11   26   11 o 110.3343 1.144731   115.6181   282.0   121.8824 2.526060          ?        ? 
1 1 1   11   26   12 o 10.71734 3.897358   14.97274   211.9  0.9623086 1.082597          ?        ? 
1 1 1   11   26   13 o 8.694008 3.712163   7.694105    51.2   0.000000 1.142741          ?        ? 
1 1 1   11   26   14 o 37.21714 1.535235   39.04724    90.9   13.92340 1.142741          ?        ? 
1 1 1   11   26   15 o 53.91693 1.394374   57.59124   251.3   29.23012 1.503607          ?        ? 
1 1 1   11   26   16 o 30.01887 2.203904   26.31224   276.9   9.172004 1.323174          ?        ? 
1 1 1   11   26   17 o 31.69888 1.992231   43.14246   278.0   10.25460 1.263030          ?        ? 
1 1 1   11   26   18 o 26.81050 2.299393   25.42232    64.8   7.427820 1.232958          ?        ? 
1 1 1   11   26   19 f 32.03292 1.971456   25.95107   333.9   10.61547 1.263030          ?        ? 
1 1 1   11   26   20 o 12.54528 4.186157   11.61707   112.8   1.954689 1.232958          ?        ? 
1 1 1   11   27    0 o 71.41924 1.897759   78.45457   180.0   51.15272 2.706493   51.15272 2.706493 
1 1 1   11   27    1 o 117.5161 1.202721   151.9956   254.1   138.1815 2.826782          ?        ? 
1 1 1   11   27    2 o 65.95042 1.071555   87.91571   317.5   43.51439 1.413391          ?        ? 
1 1 1   11   27    3 o 75.94914 1.029473   76.34492    70.8   57.70844 1.563751          ?        ? 
1 1 1   11   27    4 o 123.6163 1.204187   99.54453   294.8   152.9169 2.977142          ?        ? 
1 1 1   11   27    5 f 218.1676 1.695428   217.4601   335.9   476.6134 7.397748          ?        ? 
1 1 1   11   27    6 o 66.87174 1.056792   57.73072   263.9   44.74735 1.413391          ?        ? 
1 1 1   11   27    7 o 128.0077 1.162876   115.1735   301.0   163.9834 2.977142          ?        ? 
1 1 1   11   27    8 o 155.9200 1.330796   181.7910   238.9   243.3739 4.149956          ?        ? 
1 1 1   11   27    9 f 19.72535 2.667950   26.94343   338.9   3.909379 1.052525          ?        ? 
1 1 1   11   27   10 o 84.01786 1.163258   68.47015   125.6   70.66954 1.954689          ?        ? 
1 1 1   11   27   11 o 115.2268 1.161371   121.3580    70.8   132.9490 2.676421          ?        ? 
1 1 1   11   27   12 o 31.81939 1.795668   37.49482    35.0   10.16438 1.142741          ?        ? 
1 1 1   11   27   13 o 70.34062 1.154309   73.49388    55.0   49.58897 1.623896          ?        ? 
1 1 1   11   27   14 o 62.16864 1.257669   77.17820    57.9   38.79307 1.563751          ?        ? 
1 1 1   11   27   15 o 32.34472 1.952452   36.26446   176.6   10.58539 1.263030          ?        ? 
1 1 1   11   27   16 o 21.01962 2.575206   19.10946   240.6   4.540894 1.082597          ?        ? 
1 1 1   11   27   17 o 11.97381 4.131782   6.081495     0.9   1.503607 1.202886          ?        ? 
1 1 1   11   27   18 o 38.56375 1.715568   42.84159    79.2   15.18643 1.323174          ?        ? 
1 1 1   11   27   19 o 15.26296 3.517767   17.89404   166.7   2.706493 1.052525          ?        ? 
1 1 1   11   28    0 o 36.74237 2.352404   71.91555   180.0   13.68283 1.714112   13.68283 1.714112 
1 1 1   11   28    1 o 179.6212 1.473294   204.3914   138.7   322.9748 5.292697          ?        ? 
1 1 1   11   28    2 o 50.12352 1.169924   49.21098     5.0   25.14031 1.172814          ?        ? 
1 1 1   11   28    3 o 90.96358 1.074435   104.6367    77.3   82.78861 1.954689          ?        ? 
1 1 1   11   28    4 o 39.93952 1.430590   26.02748   305.5   15.96831 1.142741          ?        ? 
1 1 1   11   28    5 o 57.15081 1.157616   69.81934   176.1   32.68842 1.323174          ?        ? 
1 1 1   11   28    6 o 51.51181 1.138393   50.32021   213.6   26.55371 1.172814          ?        ? 
1 1 1   11   28    7 o 85.01315 1.078892   97.78757   228.5   72.32351 1.834401          ?        ? 
1 1 1   11   28    8 o 55.73775 1.159988   69.07583   246.9   31.09460 1.293102          ?        ? 
1 1 1   11   28    9 o 56.95921 1.161511   42.61335    35.9   32.47792 1.323174          ?        ? 
1 1 1   11   28   10 o 46.65178 1.353678   50.07588   359.5   21.80231 1.263030          ?        ? 
1 1 1   11   28   11 o 79.55854 1.115064   77.39223   188.5   63.39208 1.774257          ?        ? 
1 1 1   11   28   12 o 60.47961 1.193347   58.20418    34.6   36.65794 1.443463          ?        ? 
1 1 1   11   28   13 o 45.50625 1.486880   59.57016   250.3   20.80992 1.353247          ?        ? 
1 1 1   11   28   14 o 32.23839 1.865611   30.62303    65.9   10.49518 1.202886          ?        ? 
1 1 1   11   28   15 o 16.24662 3.523376   32.30340   187.7   2.856854 1.112669          ?        ? 
1 1 1   11   28   16 o 13.49676 4.035677   9.565020   138.5   2.014834 1.172814          ?        ? 
1 1 1   11   28   17 o 14.12107 3.913507   20.20086   317.7   2.255411 1.142741          ?        ? 
1 1 1   11   28   18 o 15.92515 3.662069   14.96387    43.5   2.916998 1.142741          ?        ? 
1 1 1   11   28   19 o 7.928574 3.475214   4.553812   110.8       0.06 1.052525          ?        ? 
1 1 1   11   29    0 o 58.84214 1.432867   39.07214   180.0   34.70325 1.684040   34.70325 1.684040 
1 1 1   11   29    1 o 54.57205 1.157213   74.78031   336.9   29.80149 1.263030          ?        ? 
1 1 1   11   29    2 o 76.06253 1.027938   98.55155   148.6   57.88888 1.563751          ?        ? 
1 1 1   11   29    3 o 115.0742 1.162911   96.65542   256.1   132.5279 2.676421          ?        ? 
1 1 1   11   29    4 o 83.22929 1.065885   86.93332   177.8   69.31629 1.774257          ?        ? 
1 1 1   11   29    5 o 95.92776 1.081532   111.8675   104.9   92.08091 2.074978          ?        ? 
1 1 1   11   29    6 o 36.59468 1.561349   41.31248     6.7   13.41218 1.142741          ?        ? 
1 1 1   11   29    7 o 43.29369 1.319755   30.90557   265.5   18.76502 1.142741          ?        ? 
1 1 1   11   29    8 o 7.913180 3.420789   5.070000   314.4 -0.1202886 0.9923807          ?        ? 
1 1 1   11   29    9 o 22.93841 2.490890   18.76815    29.8   5.292697 1.142741          ?        ? 
1 1 1   11   29   10 o 26.56891 2.150524   30.45947   339.4   7.097026 1.142741          ?        ? 
1 1 1   11   29   11 f 55.07515 1.283147   55.00150   316.7   30.40294 1.413391          ?        ? 
1 1 1   11   29   12 o 32.20494 1.774171   36.32563   273.9   10.43503 1.142741          ?        ? 
1 1 1   11   29   13 o 33.20417 1.947199   39.38110   321.3   11.12669 1.293102          ?        ? 
1 1 1   11   29   14 o 39.31006 1.606497   52.49774   334.2   15.57737 1.263030          ?        ? 
1 1 1   11   29   15 o 12.39733 3.971870   11.09623    46.5   1.623896 1.112669          ?        ? 
1 1 1   11   29   16 o 19.51189 3.005382   12.31955    17.5   3.999595 1.172814          ?        ? 
1 1 1   11   29   17 o 43.35772 1.525881   30.26350   242.0   19.09581 1.323174          ?        ? 
1 1 1   11   29   18 o 9.063146 3.836796   4.631373   317.7  0.3608657 1.202886          ?        ? 
1 1 1   11   29   19 o 16.56157 3.470612   13.93558   221.1   3.247792 1.112669          ?        ? 
1 1 1   11   30    0 o 47.35432 1.655545   43.92610    -0.0   22.52404 1.563751   22.52404 1.563751 
1 1 1   11   30    1 o 135.9535 1.271868   118.0018   329.9   185.0038 3.458297          ?        ? 
1 1 1   11   30    2 o 110.9028 1.152420   96.71124   246.5   123.0853 2.556132          ?        ? 
1 1 1   11   30    3 o 110.6403 1.223105   108.7995   246.9   122.5139 2.706493          ?        ? 
1 1 1   11   30    4 o 151.7580 1.297939   149.9937   290.1   230.5331 3.939451          ?        ? 
1 1 1   11   30    5 o 44.31958 1.390985   56.72860   249.1   19.66718 1.232958          ?        ? 
1 1 1   11   30    6 o 63.61787 1.134479   74.16129    87.1   40.50718 1.443463          ?        ? 
1 1 1   11   30    7 o 82.72672 1.126887   85.96381   107.6   68.50435 1.864473          ?        ? 
1 1 1   11   30    8 o 73.77273 1.141370   88.19946    83.1   54.49073 1.684040          ?        ? 
1 1 1   11   30    9 o 52.41059 1.262316   60.42592    24.4   27.51601 1.323174          ?        ? 
1 1 1   11   30   10 o 25.58388 2.233323   25.35553    39.5   6.585800 1.142741          ?        ? 
1 1 1   11   30   11 o 70.64930 1.106700   78.41309   138.7   50.00998 1.563751          ?        ? 
1 1 1   11   30   12 o 43.19454 1.357595   43.02699   273.3   18.73495 1.172814          ?        ? 
1 1 1   11   30   13 o 28.38262 2.013101   35.54587   322.5   8.149551 1.142741          ?        ? 
1 1 1   11   30   14 o 29.21424 2.007264   29.34508   287.0   8.660777 1.172814          ?        ? 
1 1 1   11   30   15 o 15.77725 3.764032   11.14730   305.2   2.766637 1.172814          ?        ? 
1 1 1   11   30   16 o 11.46851 4.114292   5.130094   252.2   1.323174 1.202886          ?        ? 
1 1 1   11   30   17 o 15.32200 3.911423   17.53052   300.9   2.736565 1.202886          ?        ? 
1 1 1   11   30   18 o 8.949345 3.788572   9.388261   312.9  0.4210100 1.172814          ?        ? 
1 1 1   11   31    0 o 19.89650 3.789637   46.02265     0.0   4.360461 1.353247   4.360461 1.353247 
1 1 1   11   31    1 o 190.2875 1.588255   174.9268   121.2   362.6400 6.044501          ?        ? 
1 1 1   11   31    2 o 33.05585 1.683014   36.21859    39.3   10.94626 1.112669          ?        ? 
1 1 1   11   31    3 o 80.16912 1.125326   68.98608   286.6   64.32432 1.804329          ?        ? 
1 1 1   11   31    4 o 80.17113 1.087788   63.25629   163.2   64.32432 1.744184          ?        ? 
1 1 1   11   31    5 o 29.03588 1.812456   23.58784   353.2   8.450273 1.052525          ?        ? 
1 1 1   11   31    6 o 72.85900 1.114410   70.20969   181.2   53.13748 1.623896          ?        ? 
1 1 1   11   31    7 o 97.49422 1.187534   105.9421   171.9   95.17834 2.315555          ?        ? 
1 1 1   11   31    8 o 81.45117 1.107614   79.97400     7.2   66.42937 1.804329          ?        ? 
1 1 1   11   31    9 o 42.73610 1.512892   52.82955   120.1   18.31394 1.293102          ?        ? 
1 1 1   11   31   10 o 52.30284 1.293665   53.68009    57.7   27.42579 1.353247          ?        ? 
1 1 1   11   31   11 o 31.67904 1.756160   25.52377   259.6   10.10424 1.112669          ?        ? 
1 1 1   11   31   12 o 38.31159 1.491378   31.61735   224.2   14.76542 1.142741          ?        ? 
1 1 1   11   31   13 o 26.76475 2.190967   26.38044   351.5   7.277459 1.172814          ?        ? 
1 1 1   11   31   14 o 42.14686 1.569719   44.04268   199.7   17.95307 1.323174          ?        ? 
1 1 1   11   31   15 o 30.49200 1.972461   33.54327    50.5   9.502798 1.202886          ?        ? 
1 1 1   11   31   16 o 24.80015 2.485787   27.50916   214.3   6.405366 1.232958          ?        ? 
1 1 1   11   31   17 o 25.27331 2.558237   25.84586   289.8   6.766232 1.293102          ?        ? 
1 1 1   11   31   18 o 11.47520 4.020641   14.12395    48.2   1.563751 1.142741          ?        ? 
1 1 1   11   32    0 o 150.1348 1.823342   142.3957     0.0   225.7516 5.473131   225.7516 5.473131 
1 1 1   11   32    1 o 85.71064 1.140284   88.80664   308.0   73.52639 1.954689          ?        ? 
1 1 1   11   32    2 o 98.98235 1.169681   91.14061   163.7   98.06527 2.315555          ?        ? 
1 1 1   11   32    3 o 31.41754 1.818636   18.30917   218.5   9.893736 1.142741          ?        ? 
1 1 1   11   32    4 o 78.46085 1.092336   72.49782   304.0   61.61782 1.714112          ?        ? 
1 1 1   11   32    5 o 75.60789 1.113667   80.76719    65.7   57.22729 1.684040          ?        ? 
1 1 1   11   32    6 o 40.25435 1.494107   58.19314   209.5   16.23896 1.202886          ?        ? 
1 1 1   11   32    7 o 57.17822 1.235952   65.50394   189.1   32.74857 1.413391          ?        ? 
1 1 1   11   32    8 o 43.11871 1.534339   54.61820   305.0   18.64473 1.323174          ?        ? 
1 1 1   11   32    9 o 48.76784 1.325774   61.33324   198.5   23.84721 1.293102          ?        ? 
1 1 1   11   32   10 o 49.84790 1.236720   49.23384   219.2   24.92981 1.232958          ?        ? 
1 1 1   11   32   11 o 23.61741 2.355613   30.50323   182.1   5.653563 1.112669          ?        ? 
1 1 1   11   32   12 o 36.52199 1.605627   20.43601   227.7   13.44225 1.172814          ?        ? 
1 1 1   11   32   13 o 9.207721 3.809206   14.56859   155.9  0.3307936 1.142741          ?        ? 
1 1 1   11   32   14 o 18.29465 3.579561   5.093153    36.7   3.668802 1.263030          ?        ? 
1 1 1   11   32   15 o 42.19868 1.639054   32.02732   330.3   18.10343 1.383319          ?        ? 
1 1 1   11   32   16 o 10.61069 4.056131   18.48511   209.5   1.052525 1.202886          ?        ? 
1 1 1   11   32   17 o 12.34788 4.186164   15.65423    86.5   1.834401 1.232958          ?        ? 
1 1 1   11   33    0 o 25.89315 2.908801   28.41089    -0.0   6.976738 1.473535   6.976738 1.473535 
1 1 1   11   33    1 o 104.8237 1.190565   118.9096   161.2   110.0039 2.495988          ?        ? 
1 1 1   11   33    2 o 85.52294 1.177949   72.81861   298.5   73.22567 2.014834          ?        ? 
1 1 1   11   33    3 o 160.9102 1.354936   154.9946   222.1   259.3422 4.360461          ?        ? 
1 1 1   11   33    4 o 125.3274 1.259730   118.0345   343.5   157.3074 3.157575          ?        ? 
1 1 1   11   33    5 o 101.4453 1.200570   114.4465   302.7   103.0572 2.435844          ?        ? 
1 1 1   11   33    6 o 61.28439 1.177676   50.16551    19.3   37.62025 1.443463          ?        ? 
1 1 1   11   33    7 o 50.68358 1.305328   54.19292    14.8   25.74175 1.323174          ?        ? 
1 1 1   11   33    8 o 51.28339 1.348700   55.29094   349.6   26.37327 1.383319          ?        ? 
1 1 1   11   33    9 o 11.72208 4.076437   27.19082   260.9   1.293102 1.172814          ?        ? 
1 1 1   11   33   10 o 78.74335 1.126607   89.94445    13.3   62.18920 1.774257          ?        ? 
1 1 1   11   33   11 o 43.28280 1.493783   30.72940   176.5   18.85523 1.293102          ?        ? 
1 1 1   11   33   12 o 48.29808 1.369800   45.15157   237.4   23.48635 1.323174          ?        ? 
1 1 1   11   33   13 o 18.07261 3.622087   13.28019   285.9   3.578585 1.263030          ?        ? 
1 1 1   11   33   14 o 33.05182 2.092651   31.09140   264.2   11.21691 1.383319          ?        ? 
1 1 1   11   33   15 o 18.26928 3.584473   20.35155   263.4   3.728946 1.263030          ?        ? 
1 1 1   11   33   16 o 31.11923 1.932705   31.30334   350.7   10.01402 1.202886          ?        ? 
1 1 1   11   33   17 o 10.37456 4.169631   11.15274    54.4   1.022453 1.323174          ?        ? 
1 1 1   11   34    0 o 16.94946 4.722076   18.00473   180.0   3.488369 1.383319   3.488369 1.383319 
1 1 1   11   34    1 o 116.3408 1.279492   120.2286   164.2   135.5652 2.977142          ?        ? 
1 1 1   11   34    2 o 34.75696 1.816946   33.59506   332.2   12.11907 1.263030          ?        ? 
1 1 1   11   34    3 o 10.33384 3.875360   31.29044   196.3  0.8119479 1.082597          ?        ? 
1 1 1   11   34    4 o 74.43211 1.131259   88.90878   242.7   55.48311 1.684040          ?        ? 
1 1 1   11   34    5 o 47.27400 1.431280   39.16322   332.5   22.40375 1.353247          ?        ? 
1 1 1   11   34    6 o 34.87159 1.724736   32.91373   343.2   12.20929 1.202886          ?        ? 
1 1 1   11   34    7 o 68.22649 1.146000   55.71493   304.2   46.64190 1.563751          ?        ? 
1 1 1   11   34    8 o 10.09291 3.850954   11.41676    20.0  0.7518036 1.082597          ?        ? 
1 1 1   11   34    9 o 33.94730 1.771696   40.73387   202.8   11.60785 1.202886          ?        ? 
1 1 1   11   34   10 o 59.44419 1.214133   51.46168   117.2   35.48513 1.443463          ?        ? 
1 1 1   11   34   11 o 77.37034 1.166034   69.29409    77.3   60.14429 1.804329          ?        ? 
1 1 1   11   34   12 o 29.36815 1.843148   31.77642     2.6   8.750995 1.082597          ?        ? 
1 1 1   11   34   13 o 45.64928 1.646912   39.17705   329.3   21.14072 1.503607          ?        ? 
1 1 1   11   34   14 o 50.62426 1.544469   47.76189   328.8   26.01241 1.563751          ?        ? 
1 1 1   11   34   15 o 25.37694 2.547790   19.71260    11.3   6.796305 1.293102          ?        ? 
1 1 1   11   34   16 o 7.258212 3.406281   2.588648   182.0 -0.9021643 1.263030          ?        ? 
1 1 1   11   35    0 o 59.60481 1.642465   26.53649   180.0   35.66556 1.954689   35.66556 1.954689 
1 1 1   11   35    1 o 53.25414 1.298790   27.77488   272.4   28.41818 1.383319          ?        ? 
1 1 1   11   35    2 o 74.21767 1.215566   79.25471   359.3   55.18238 1.804329          ?        ? 
1 1 1   11   35    3 o 125.7910 1.207275   122.1290    67.5   158.5103 3.037287          ?        ? 
1 1 1   11   35    4 o 54.64151 1.293331   51.76217   341.3   29.92178 1.413391          ?        ? 
1 1 1   11   35    5 o 48.73059 1.388498   51.99456   119.9   23.81714 1.353247          ?        ? 
1 1 1   11   35    6 o 46.23157 1.398506   44.53718   283.1   21.44144 1.293102          ?        ? 
1 1 1   11   35    7 o 29.54251 2.086752   34.28963   302.1   8.811138 1.232958          ?        ? 
1 1 1   11   35    8 o 30.38655 2.028789   35.83113    85.1   9.322365 1.232958          ?        ? 
1 1 1   11   35    9 o 50.92164 1.387810   48.98454    72.9   26.07255 1.413391          ?        ? 
1 1 1   11   35   10 o 52.68132 1.284370   50.85412   272.6   27.90695 1.353247          ?        ? 
1 1 1   11   35   11 o 29.53366 2.087377   29.63619   278.5   8.871283 1.232958          ?        ? 
1 1 1   11   35   12 o 29.31497 2.051658   30.39806   320.1   8.781067 1.202886          ?        ? 
1 1 1   11   35   13 o 15.83413 3.333471   17.87419   169.4   2.766637 1.022453          ?        ? 
1 1 1   11   35   14 f 21.48659 3.149050   19.76378    23.4   4.961904 1.353247          ?        ? 
1 1 1   11   35   15 o 33.22547 2.126969   22.90010   276.1   11.51763 1.413391          ?        ? 
1 1 1   11   35   16 o 24.63040 2.747106   29.66607   120.4   6.645944 1.353247          ?        ? 
1 1 1   11   36    0 o 16.35816 5.144039   13.24687     0.0   3.398152 1.473535   3.398152 1.473535 
1 1 1   11   36    1 o 61.85291 1.239779   36.84679   260.4   38.34198 1.533679          ?        ? 
1 1 1   11   36    2 o 89.88647 1.137494   77.89718    18.7   80.95422 2.044906          ?        ? 
1 1 1   11   36    3 o 38.02721 1.700233   42.99033   230.2   14.52485 1.293102          ?        ? 
1 1 1   11   36    4 o 70.87203 1.188085   69.86294    43.8   50.34077 1.684040          ?        ? 
1 1 1   11   36    5 o 6.916091 3.236948   10.63237    65.9  -1.052525 1.112669          ?        ? 
1 1 1   11   36    6 o 38.66694 1.594331   31.72377   114.9   15.03607 1.232958          ?        ? 
1 1 1   11   36    7 o 14.69080 3.687202   16.45218   212.5   2.315555 1.082597          ?        ? 
1 1 1   11   36    8 o 35.44224 1.654542   30.52968   305.0   12.66037 1.172814          ?        ? 
1 1 1   11   36    9 o 70.91687 1.166131   63.92840   171.0   50.52120 1.653968          ?        ? 
1 1 1   11   36   10 o 34.65786 1.735372   25.18212   161.8   12.14915 1.202886          ?        ? 
1 1 1   11   36   11 o 36.04816 1.626731   38.09760   194.7   13.17160 1.172814          ?        ? 
1 1 1   11   36   12 o 32.49286 1.897275   28.55820   322.5   10.79590 1.232958          ?        ? 
1 1 1   11   36   13 o 28.30229 2.178195   21.29065   300.8   8.269840 1.232958          ?        ? 
1 1 1   11   36   14 o 38.93106 1.892493   34.76875   110.9   15.63752 1.473535          ?        ? 
1 1 1   11   36   15 o 12.51659 4.332062   18.19110    49.6   1.924617 1.323174          ?        ? 
1 1 1   11   37    0 o 107.4627 1.511796   76.21705   180.0   115.7778 3.247792   115.7778 3.247792 
1 1 1   11   37    1 o 61.34157 1.299138   63.41057   333.7   37.74054 1.593824          ?        ? 
1 1 1   11   37    2 o 21.15962 2.700289   18.54074    68.3   4.540894 1.142741          ?        ? 
1 1 1   11   37    3 o 34.26382 1.755329   27.10510   218.3   11.81835 1.202886          ?        ? 
1 1 1   11   37    4 o 35.49872 1.778980   29.39602   264.4   12.69044 1.263030          ?        ? 
1 1 1   11   37    5 o 65.00323 1.225957   61.05264    95.2   42.40173 1.593824          ?        ? 
1 1 1   11   37    6 o 11.73382 3.976722   18.67265   131.1   1.353247 1.112669          ?        ? 
1 1 1   11   37    7 o 12.56340 3.902149   11.56139    96.1   1.653968 1.082597          ?        ? 
1 1 1   11   37    8 o 55.49279 1.300586   61.19361    99.4   30.97431 1.443463          ?        ? 
1 1 1   11   37    9 o 13.62231 3.959299   12.77388    27.8   2.014834 1.142741          ?        ? 
1 1 1   11   37   10 o 18.25480 3.502004   17.71078   185.1   3.638730 1.232958          ?        ? 
1 1 1   11   37   11 o 19.75394 2.816323   10.34598   252.5   4.089812 1.112669          ?        ? 
1 1 1   11   37   12 o 29.99575 2.005094   29.94625   170.6   9.232149 1.202886          ?        ? 
1 1 1   11   37   13 o 7.375541 3.418710   12.93041    34.0 -0.7518036 1.202886          ?        ? 
1 1 1   11   37   14 o 10.87988 4.231545   16.69110    22.6   1.202886 1.323174          ?        ? 
1 1 1   11   38    0 o 39.17990 2.045780   46.64528   180.0   15.54730 1.593824   15.54730 1.593824 
1 1 1   11   38    1 o 45.07277 1.501180   58.25273   330.2   20.41899 1.353247          ?        ? 
1 1 1   11   38    2 o 15.81247 3.679277   7.184245   308.5   2.676421 1.142741          ?        ? 
1 1 1   11   38    3 o 27.57934 2.235293   26.26668    76.0   7.698469 1.232958          ?        ? 
1 1 1   11   38    4 o 54.05191 1.307438   44.48510   119.1   29.35041 1.413391          ?        ? 
1 1 1   11   38    5 o 39.78551 1.549506   23.76084   206.0   15.93824 1.232958          ?        ? 
1 1 1   11   38    6 o 31.39972 2.011212   21.67306   160.1   9.983953 1.263030          ?        ? 
1 1 1   11   38    7 o 44.89488 1.540619   44.32169   345.5   20.32877 1.383319          ?        ? 
1 1 1   11   38    8 o 19.61572 3.142781   22.62862   118.6   3.999595 1.232958          ?        ? 
1 1 1   11   38    9 o 14.05000 3.847949   11.12300   111.5   2.195267 1.112669          ?        ? 
1 1 1   11   38   10 o 18.77169 3.123889   20.29170   195.4   3.728946 1.172814          ?        ? 
1 1 1   11   38   11 o 30.36429 2.079795   31.22463   348.4   9.472726 1.263030          ?        ? 
1 1 1   11   38   12 o 13.67659 4.268063   13.28947   242.3   2.195267 1.293102          ?        ? 
1 1 1   11   38   13 o 26.78316 2.301741   27.43729    44.5   7.548109 1.232958          ?        ? 
1 1 1   11   38   14 o 12.94918 4.562825   10.26402   173.8   2.135122 1.473535          ?        ? 
1 1 1   11   39    0 o 5.276451 3.719527   3.487070   180.0  -1.353247 1.443463  -1.353247 1.443463 
1 1 1   11   39    1 o 41.55002 1.338952   47.70173   354.3   17.35163 1.112669          ?        ? 
1 1 1   11   39    2 o 9.901523 3.874341   8.627819    75.6  0.6615872 1.112669          ?        ? 
1 1 1   11   39    3 o 95.24928 1.215524   87.72901    45.5   91.11860 2.315555          ?        ? 
1 1 1   11   39    4 o 52.61499 1.371722   49.57809   157.5   27.84681 1.443463          ?        ? 
1 1 1   11   39    5 o 18.36390 3.402933   18.76771   243.3   3.608657 1.202886          ?        ? 
1 1 1   11   39    6 o 54.62148 1.266277   46.16872    21.1   30.01200 1.383319          ?        ? 
1 1 1   11   39    7 o 9.649893 3.844645   11.91761   120.4  0.6014429 1.112669          ?        ? 
1 1 1   11   39    8 o 25.45492 2.421846   22.79677    30.0   6.676016 1.232958          ?        ? 
1 1 1   11   39    9 o 10.61098 3.981107   7.197293    22.9   1.022453 1.142741          ?        ? 
1 1 1   11   39   10 o 26.84397 2.352539   18.76584   198.9   7.457891 1.263030          ?        ? 
1 1 1   11   39   11 o 12.49911 4.027267   6.262211   350.8   1.774257 1.142741          ?        ? 
1 1 1   11   39   12 o 33.21256 2.037251   27.34186   325.5   11.45749 1.353247          ?        ? 
1 1 1   11   39   13 o 21.62312 2.781481   25.93527    30.5   5.112265 1.202886          ?        ? 
1 1 1   11   40    0 o 31.15736 2.592407   25.64703    -0.0   10.01402 1.593824   10.01402 1.593824 
1 1 1   11   40    1 o 25.63481 2.170232   29.63552   230.3   6.676016 1.112669          ?        ? 
1 1 1   11   40    2 o 51.36739 1.346495   39.33757   136.6   26.55371 1.383319          ?        ? 
1 1 1   11   40    3 o 58.07611 1.346295   47.34872   161.0   33.95145 1.563751          ?        ? 
1 1 1   11   40    4 o 75.24931 1.198900   72.49010   140.7   56.92657 1.804329          ?        ? 
1 1 1   11   40    5 f 44.42127 1.455499   43.55351   182.0   19.90776 1.293102          ?        ? 
1 1 1   11   40    6 o 20.97707 3.010501   19.58743    90.9   4.601038 1.263030          ?        ? 
1 1 1   11   40    7 o 34.24781 1.843958   32.07660   169.1   11.93864 1.263030          ?        ? 
1 1 1   11   40    8 f 14.88197 4.039456   14.76290   310.6   2.526060 1.232958          ?        ? 
1 1 1   11   40    9 o 14.36078 3.958328   16.70053   265.6   2.345627 1.172814          ?        ? 
1 1 1   11   40   10 o 24.34010 2.532771   19.30357   330.2   6.224934 1.232958          ?        ? 
1 1 1   11   40   11 o 37.57220 1.840880   31.37695   214.8   14.55492 1.383319          ?        ? 
1 1 1   11   40   12 o 30.04694 2.101762   25.58382    91.7   9.502798 1.263030          ?        ? 
1 1 1   11   41    0 o 67.44205 1.629633   59.42758   360.0   45.79988 2.195267   45.79988 2.195267 
1 1 1   11   41    1 o 52.52615 1.230913   45.91121    98.8   27.75659 1.293102          ?        ? 
1 1 1   11   41    2 o 54.97599 1.367513   57.33189    53.7   30.46308 1.503607          ?        ? 
1 1 1   11   41    3 o 23.73599 2.533886   24.80201   348.5   5.803924 1.202886          ?        ? 
1 1 1   11   41    4 o 15.16082 3.778014   6.190280   113.8   2.556132 1.142741          ?        ? 
1 1 1   11   41    5 o 27.89445 2.156139   21.85188   242.9   7.969118 1.202886          ?        ? 
1 1 1   11   41    6 o 19.84414 3.030834   27.60824   208.7   4.149956 1.202886          ?        ? 
1 1 1   11   41    7 o 7.878867 3.545439   8.744446   110.4 -0.3909379 1.172814          ?        ? 
1 1 1   11   41    8 f 30.09539 2.098378   18.25840    35.1   9.322365 1.263030          ?        ? 
1 1 1   11   41    9 o 10.69056 4.065010   12.37954   194.1   1.082597 1.202886          ?        ? 
1 1 1   11   41   10 o 28.22968 2.396850   19.00399   191.5   8.390128 1.353247          ?        ? 
1 1 1   11   41   11 o 11.15763 4.056594   12.48575   328.6   1.413391 1.172814          ?        ? 
1 1 1   11   42    0 o 58.93490 1.738220   35.29289     0.0   35.09419 2.044906   35.09419 2.044906 
1 1 1   11   42    1 o 8.760063 3.641805   10.36216     1.2  0.3007214 1.052525          ?        ? 
1 1 1   11   42    2 o 38.20352 1.849817   37.72093     1.9   14.85564 1.413391          ?        ? 
1 1 1   11   42    3 o 32.57227 1.938812   25.74753   106.3   10.82597 1.263030          ?        ? 
1 1 1   11   42    4 o 25.88034 2.323937   25.25074   327.3   6.916593 1.202886          ?        ? 
1 1 1   11   42    5 o 21.29914 2.753196   24.01073   277.2   4.751399 1.172814          ?        ? 
1 1 1   11   42    6 o 44.00825 1.639992   34.17940   338.2   19.69725 1.443463          ?        ? 
1 1 1   11   42    7 o 19.10634 3.147871   21.40261   105.4   3.909379 1.202886          ?        ? 
1 1 1   11   42    8 o 25.52593 2.474014   20.86666   174.6   6.856449 1.263030          ?        ? 
1 1 1   11   42    9 o 28.78825 2.350345   24.12586    69.3   8.720922 1.353247          ?        ? 
1 1 1   11   42   10 o 22.92130 2.886343   19.81513   350.6   5.773852 1.323174          ?        ? 
1 1 1   11   43    0 o 21.54126 3.928525   25.19804   180.0   5.232553 1.533679   5.232553 1.533679 
1 1 1   11   43    1 o 42.28063 1.422502   32.82795   317.7   18.10343 1.202886          ?        ? 
1 1 1   11   43    2 o 31.42348 2.057542   25.53297   121.4   10.13431 1.293102          ?        ? 
1 1 1   11   43    3 o 23.53307 2.619628   26.64971    88.9   5.773852 1.232958          ?        ? 
1 1 1   11   43    4 o 22.55950 2.666029   21.67614   267.8   5.322770 1.202886          ?        ? 
1 1 1   11   43    5 o 30.44953 2.320874   32.15923   288.0   9.623086 1.413391          ?        ? 
1 1 1   11   43    6 o 36.56981 1.767992   33.10906     8.7   13.71290 1.293102          ?        ? 
1 1 1   11   43    7 o 21.78460 2.829884   20.40756    74.2   5.082192 1.232958          ?        ? 
1 1 1   11   43    8 o 34.08757 1.984956   28.41787   260.5   12.08900 1.353247          ?        ? 
1 1 1   11   43    9 o 5.926734 2.906932   4.592465   107.6  -1.954689 1.172814          ?        ? 
1 1 1   11   44    0 o 46.92514 2.124164   28.41114   180.0   22.49397 1.984761   22.49397 1.984761 
1 1 1   11   44    1 o 34.48442 1.656895   30.84281    99.5   12.11907 1.142741          ?        ? 
1 1 1   11   44    2 o 9.749666 3.951904   19.96655   216.3  0.6315150 1.202886          ?        ? 
1 1 1   11   44    3 o 14.43282 4.152014   8.544230   226.1   2.435844 1.263030          ?        ? 
1 1 1   11   44    4 o 38.33389 1.804302   37.67572   157.2   15.09622 1.383319          ?        ? 
1 1 1   11   44    5 o 36.31641 1.863134   28.78769   305.3   13.59261 1.353247          ?        ? 
1 1 1   11   44    6 o 24.99481 2.586742   31.47185   356.9   6.645944 1.293102          ?        ? 
1 1 1   11   44    7 o 12.01861 4.270351   9.906217   291.6   1.714112 1.293102          ?        ? 
1 1 1   11   44    8 o 20.57522 3.142378   14.61896    65.7   4.751399 1.293102          ?        ? 
1 1 1   11   45    0 o 13.30515 5.748058   9.654005    -0.0   2.796710 1.563751   2.796710 1.563751 
1 1 1   11   45    1 f 8.038722 3.473608   2.045838    41.9       0.09 1.022453          ?        ? 
1 1 1   11   45    2 o 20.30973 3.109420   24.69600   212.4   4.480750 1.263030          ?        ? 
1 1 1   11   45    3 o 18.48449 3.463132   16.76543   231.4   3.879307 1.232958          ?        ? 
1 1 1   11   45    4 o 6.804738 3.269417   9.499804   121.1  -1.503607 1.293102          ?        ? 
1 1 1   11   45    5 o 9.980140 4.047782   9.214801   289.2  0.8420200 1.263030          ?        ? 
1 1 1   11   45    6 o 21.77679 2.830898   19.85623    38.8   5.202481 1.232958          ?        ? 
1 1 1   11   45    7 o 29.26497 2.209300   17.85402   105.0   9.111859 1.293102          ?        ? 
1 1 1   11   46    0 o 20.64829 4.589560   7.646604   180.0   5.232553 1.653968   5.232553 1.653968 
1 1 1   11   46    1 o 28.17771 2.294549   21.01335   287.1   8.420200 1.293102          ?        ? 
1 1 1   11   46    2 o 13.95060 4.064556   12.32687   109.1   2.405771 1.202886          ?        ? 
1 1 1   11   46    3 o 22.89794 2.823622   11.82031   201.6   5.743780 1.293102          ?        ? 
1 1 1   11   46    4 o 28.53686 2.265670   15.92422   290.4   8.660777 1.293102          ?        ? 
1 1 1   11   46    5 o 10.35486 4.105400   13.81654   212.1   1.082597 1.263030          ?        ? 
1 1 1   11   47    0 o 9.130905 5.417598   2.188929   180.0   1.413391 1.684040   1.413391 1.684040 
1 1 1   11   47    1 o 29.93869 2.310252   20.05511    43.9   9.593014 1.383319          ?        ? 
1 1 1   12    0    0 o 128.6539 1.929363   149.1551     0.0   165.6374 4.961904   165.6374 4.961904 
1 1 1   12    0    1 o 550.0287 4.511268   621.6383   180.0   3027.333 49.61904   3027.333 49.61904 
1 1 1   12    0    2 o 37.12300 0.8515672   91.48377   180.0   13.80311 0.6315150   13.80311 0.6315150 
1 1 1   12    0    3 o 309.5269 2.652775   456.6343   180.0   958.3992 16.41939   958.3992 16.41939 
1 1 1   12    0    4 o 381.8075 3.631693   432.6028     0.0   1458.499 27.72652   1458.499 27.72652 
1 1 1   12    0    5 o 645.7460 5.137359   719.3132     0.0   4172.901 66.33915   4172.901 66.33915 
1 1 1   12    0    6 o 160.1436 1.549530   180.2681     0.0   256.5455 4.961904   256.5455 4.961904 
1 1 1   12    0    7 f 241.3064 2.549164   252.7765     0.0   582.5876 12.29951   582.5876 12.29951 
1 1 1   12    0    8 o 147.6606 1.680661   145.6328     0.0   218.1433 4.961904   218.1433 4.961904 
1 1 1   12    0    9 o 80.19995 1.012767   94.48624     0.0   64.35439 1.623896   64.35439 1.623896 
1 1 1   12    0   10 o 210.5180 1.971696   267.8766     0.0   443.4138 8.299912   443.4138 8.299912 
1 1 1   12    0   11 o 115.0004 1.255517   190.7937   180.0   132.3174 2.886926   132.3174 2.886926 
1 1 1   12    0   12 f 71.05290 0.9950416   5.033071   180.0   50.52120 1.413391   50.52120 1.413391 
1 1 1   12    0   13 o 3.980982 2.711978   33.27411   180.0 -0.3007214 0.6315150 -0.3007214 0.6315150 
1 1 1   12    0   14 o 2.915334 2.140384   30.69231   180.0  -1.443463 0.6916593  -1.443463 0.6916593 
1 1 1   12    0   15 o 61.79391 1.950885   52.65771     0.0   38.34198 2.405771   38.34198 2.405771 
1 1 1   12    0   16 o 17.08817 4.277073   31.48421     0.0   3.428224 1.263030   3.428224 1.263030 
1 1 1   12    0   17 o 20.98631 4.489058   54.94005   180.0   4.991976 1.653968   4.991976 1.653968 
1 1 1   12    0   18 o 99.12445 2.445493   107.2927     0.0   98.78699 4.841615   98.78699 4.841615 
1 1 1   12    0   19 o 13.26184 5.625950   16.38719   180.0   2.556132 1.503607   2.556132 1.503607 
1 1 1   12    0   20 o 40.41111 2.247044   44.47115     0.0   16.59982 1.804329   16.59982 1.804329 
1 1 1   12    0   21 o 10.05199 4.886600   8.782553   180.0   1.563751 1.142741   1.563751 1.142741 
1 1 1   12    0   22 o 47.77896 2.949944   38.17888   180.0   23.69685 2.796710   23.69685 2.796710 
1 1 1   12    0   23 x        ?      ?   17.52925     0.0          ?        ?          ?        ? 
1 1 1   12    0   24 o 26.59543 4.625946   23.08748     0.0   8.450273 2.255411   8.450273 2.255411 
1 1 1   12    1    0 o 98.22765 1.179049   81.24335   180.0   96.53159 2.315555   96.53159 2.315555 
1 1 1   12    1    1 o 363.8250 2.239964   438.3927   149.8   1323.986 16.29910          ?        ? 
1 1 1   12    1    2 o 163.4189 1.122515   219.5351    45.0   267.0707 3.668802          ?        ? 
1 1 1   12    1    3 o 429.8087 2.560769   503.6827   229.0   1847.783 22.01281          ?        ? 
1 1 1   12    1    4 o 517.7433 2.985472   653.9156   322.7   2681.413 30.91417          ?        ? 
1 1 1   12    1    5 o 356.2929 2.105851   351.2032   167.0   1269.676 15.00600          ?        ? 
1 1 1   12    1    6 o 209.7200 1.433919   272.2591   197.9   439.8652 6.014429          ?        ? 
1 1 1   12    1    7 o 388.1457 2.638073   375.8047   174.2   1507.156 20.47913          ?        ? 
1 1 1   12    1    8 o 150.6430 1.137864   183.2754   133.8   226.9545 3.428224          ?        ? 
1 1 1   12    1    9 o 138.1795 1.077273   217.2616   250.9   190.9581 2.977142          ?        ? 
1 1 1   12    1   10 o 172.7681 1.279346   219.9151    84.9   298.5562 4.420605          ?        ? 
1 1 1   12    1   11 f 31.01914 0.8240499   69.16850   126.5   9.623086 0.5112265          ?        ? 
1 1 1   12    1   12 o 213.5693 1.570003   276.4890   176.7   456.4049 6.706088          ?        ? 
1 1 1   12    1   13 f 65.68564 0.7096196   71.82941   244.8   43.15353 0.9322364          ?        ? 
1 1 1   12    1   14 o 18.34092 1.639620   18.21024   318.2   3.368080 0.6014429          ?        ? 
1 1 1   12    1   15 o 94.41344 1.019250   97.02997   173.9   89.19398 1.924617          ?        ? 
1 1 1   12    1   16 o 34.14479 1.100905   62.13789    88.4   11.66799 0.7518036          ?        ? 
1 1 1   12    1   17 o 78.22552 1.307058   66.23619   100.0   61.28703 2.044906          ?        ? 
1 1 1   12    1   18 o 64.74510 1.555974   78.89814   237.7   42.04086 2.014834          ?        ? 
1 1 1   12    1   19 o 25.83937 2.036670   19.01277   176.8   6.736160 1.052525          ?        ? 
1 1 1   12    1   20 o 18.44820 3.297654   19.34941    30.7   3.608657 1.172814          ?        ? 
1 1 1   12    1   21 o 13.32731 4.169337   8.708166   219.4   1.924617 1.232958          ?        ? 
1 1 1   12    1   22 o 18.62967 3.438283   17.29435   331.3   3.819162 1.232958          ?        ? 
1 1 1   12    1   23 o 14.61797 4.442324   21.95064   313.0   2.586205 1.413391          ?        ? 
1 1 1   12    1   24 f 12.98575 4.937171   19.00114   314.8   2.195267 1.774257          ?        ? 
1 1 1   12    2    0 o 419.5731 3.602175   272.7777     0.0   1761.326 30.22251   1761.326 30.22251 
1 1 1   12    2    1 o 120.3417 0.9995590   246.0544   129.5   144.8275 2.405771          ?        ? 
1 1 1   12    2    2 o 291.1757 1.838355   325.4957   105.2   847.9443 10.70568          ?        ? 
1 1 1   12    2    3 o 307.6704 1.905958   362.7732   253.0   946.7313 11.72814          ?        ? 
1 1 1   12    2    4 o 93.57779 0.8194676   98.70732   245.8   87.57009 1.533679          ?        ? 
1 1 1   12    2    5 o 269.0997 1.642739   330.4263    97.9   724.2275 8.841210          ?        ? 
1 1 1   12    2    6 o 69.68862 0.8198910   63.01085   287.7   48.56651 1.142741          ?        ? 
1 1 1   12    2    7 o 249.6546 1.855007   339.2372   341.8   623.3956 9.262220          ?        ? 
1 1 1   12    2    8 o 269.2352 1.742437   321.4470   296.3   725.0394 9.382509          ?        ? 
1 1 1   12    2    9 o 191.0052 1.330380   222.7725    17.1   364.8954 5.082192          ?        ? 
1 1 1   12    2   10 o 73.65137 0.7961927   133.5116   165.3   54.25015 1.172814          ?        ? 
1 1 1   12    2   11 o 112.1340 0.9520403   124.9704   173.5   125.7617 2.135122          ?        ? 
1 1 1   12    2   12 o 130.0076 1.029333   177.8610   219.5   169.0656 2.676421          ?        ? 
1 1 1   12    2   13 o 23.06490 1.238616   24.36728   308.9   5.322770 0.5713707          ?        ? 
1 1 1   12    2   14 o 87.08805 0.8977991   106.8431   303.0   75.87202 1.563751          ?        ? 
1 1 1   12    2   15 o 101.2529 0.9504013   109.5466   289.1   102.5761 1.924617          ?        ? 
1 1 1   12    2   16 f 61.46653 0.8806396   84.72697    92.8   37.80069 1.082597          ?        ? 
1 1 1   12    2   17 o 11.90113 3.298975   33.49965   115.8   1.473535 0.8119479          ?        ? 
1 1 1   12    2   18 o 100.2426 1.274973   107.3088   139.4   100.6815 2.556132          ?        ? 
1 1 1   12    2   19 o 25.63478 2.287544   26.70698   319.6   6.645944 1.172814          ?        ? 
1 1 1   12    2   20 o 27.28452 2.479879   18.23046   261.5   7.578181 1.353247          ?        ? 
1 1 1   12    2   21 o 28.11757 2.459883   28.17280   202.8   8.119479 1.383319          ?        ? 
1 1 1   12    2   22 o 14.59640 4.201829   10.20520    76.4   2.435844 1.293102          ?        ? 
1 1 1   12    2   23 o 9.642106 4.075097   5.411857   118.5  0.4510822 1.353247          ?        ? 
1 1 1   12    2   24 o 15.47980 4.666354   18.86373   312.8   3.217719 1.563751          ?        ? 
1 1 1   12    3    0 o 92.66617 1.201181   165.3227   180.0   85.91612 2.225339   85.91612 2.225339 
1 1 1   12    3    1 o 234.0386 1.535482   230.2490   188.7   547.7942 7.187243          ?        ? 
1 1 1   12    3    2 o 446.2875 2.651517   485.6157   292.8   1992.250 23.66678          ?        ? 
1 1 1   12    3    3 o 384.8560 2.308999   552.5844   112.5   1481.414 17.77264          ?        ? 
1 1 1   12    3    4 o 368.5635 2.219325   521.3066   315.0   1358.629 16.35925          ?        ? 
1 1 1   12    3    5 o 283.0142 2.114507   376.5845   233.2   801.1219 11.96871          ?        ? 
1 1 1   12    3    6 f 163.6830 1.331984   145.0593   154.7   267.9428 4.360461          ?        ? 
1 1 1   12    3    7 o 209.2108 1.645833   186.4248   325.6   437.7602 6.886521          ?        ? 
1 1 1   12    3    8 o 83.19830 1.102427   127.9537    43.2   69.22607 1.834401          ?        ? 
1 1 1   12    3    9 o 137.3396 1.040069   177.2421   100.6   188.6426 2.856854          ?        ? 
1 1 1   12    3   10 o 96.04749 0.8610157   155.5771   241.3   92.26134 1.653968          ?        ? 
1 1 1   12    3   11 o 82.34271 0.8582367   135.2780   183.2   67.81268 1.413391          ?        ? 
1 1 1   12    3   12 o 56.37360 0.8801821   82.46867   101.8   31.78626 0.9923807          ?        ? 
1 1 1   12    3   13 o 114.3004 0.9997708   141.5716    16.2   130.6935 2.285483          ?        ? 
1 1 1   12    3   14 o 78.71068 0.9169423   87.58682    88.5   61.97869 1.443463          ?        ? 
1 1 1   12    3   15 o 14.16300 2.533276   4.927546   239.7   2.074978 0.6916593          ?        ? 
1 1 1   12    3   16 o 86.33389 0.9404742   86.51738    83.9   74.57892 1.623896          ?        ? 
1 1 1   12    3   17 o 63.24088 0.9272591   78.70523   244.1   40.02603 1.172814          ?        ? 
1 1 1   12    3   18 f 87.91898 1.077438   84.65003   158.3   77.40570 1.894545          ?        ? 
1 1 1   12    3   19 o 53.83656 1.228881   79.36258   230.2   29.07976 1.323174          ?        ? 
1 1 1   12    3   20 o 52.64049 1.142548   51.36073   176.2   27.81673 1.202886          ?        ? 
1 1 1   12    3   21 o 21.55275 2.232450   24.09482   348.2   4.751399 0.9623086          ?        ? 
1 1 1   12    3   22 o 39.83332 1.396657   37.78853   329.7   16.05853 1.112669          ?        ? 
1 1 1   12    3   23 o 13.42091 4.280008   4.922397   338.7   2.135122 1.293102          ?        ? 
1 1 1   12    4    0 o 299.0686 2.690273   463.0151   180.0   894.7665 16.08860   894.7665 16.08860 
1 1 1   12    4    1 o 135.6038 1.020118   167.3247   332.8   183.8912 2.766637          ?        ? 
1 1 1   12    4    2 o 174.7817 1.230197   222.5695   131.7   305.5029 4.300317          ?        ? 
1 1 1   12    4    3 o 254.7979 1.746748   307.8218   330.1   649.2877 8.901355          ?        ? 
1 1 1   12    4    4 o 102.6936 0.9224263   168.5853   186.6   105.4630 1.894545          ?        ? 
1 1 1   12    4    5 o 269.3094 1.993201   358.6281   155.9   725.4003 10.73576          ?        ? 
1 1 1   12    4    6 o 280.8377 2.050585   370.0592   157.1   788.8525 11.51763          ?        ? 
1 1 1   12    4    7 o 167.4129 1.383141   146.4176   179.1   280.3025 4.631110          ?        ? 
1 1 1   12    4    8 o 207.6049 1.817902   246.4077   113.2   431.1143 7.548109          ?        ? 
1 1 1   12    4    9 o 143.4789 1.404272   156.1276   302.6   205.9040 4.029667          ?        ? 
1 1 1   12    4   10 f 22.34096 1.009541   16.05781    55.2   4.991976 0.4510822          ?        ? 
1 1 1   12    4   11 f 206.4449 1.653317   247.1342    24.0   426.4230 6.826377          ?        ? 
1 1 1   12    4   12 o 187.8896 1.456475   242.5930   335.0   353.2274 5.473131          ?        ? 
1 1 1   12    4   13 o 66.56640 0.9486993   98.31747   300.9   44.32634 1.263030          ?        ? 
1 1 1   12    4   14 o 94.82097 0.9038677   115.4976   303.9   89.94579 1.714112          ?        ? 
1 1 1   12    4   15 o 47.95317 0.8779607   42.15638    42.7   23.00519 0.8420200          ?        ? 
1 1 1   12    4   16 o 37.85629 1.191565   41.41176   103.3   14.34441 0.9021643          ?        ? 
1 1 1   12    4   17 o 32.45092 1.575384   44.40513   211.2   10.55532 1.022453          ?        ? 
1 1 1   12    4   18 o 41.83277 1.222072   29.75978   290.7   17.53206 1.022453          ?        ? 
1 1 1   12    4   19 o 32.44081 1.622223   42.41839   324.3   10.58539 1.052525          ?        ? 
1 1 1   12    4   20 o 26.74404 1.742886   27.84759   355.0   7.217315 0.9322364          ?        ? 
1 1 1   12    4   21 o 10.59727 3.893069   14.74906     1.9   1.022453 1.082597          ?        ? 
1 1 1   12    4   22 o 34.34708 1.532190   34.73215    24.1   11.96871 1.052525          ?        ? 
1 1 1   12    4   23 f 10.44367 3.964727   11.54103   161.2   1.052525 1.142741          ?        ? 
1 1 1   12    5    0 o 318.3764 3.439051   393.8751     0.0   1014.213 21.89252   1014.213 21.89252 
1 1 1   12    5    1 o 294.4336 2.022285   340.9690    63.1   867.0400 11.90857          ?        ? 
1 1 1   12    5    2 o 61.31021 0.7602620   67.40041   140.2   37.59018 0.9322364          ?        ? 
1 1 1   12    5    3 o 131.9622 1.128029   144.0254   227.1   174.1478 2.977142          ?        ? 
1 1 1   12    5    4 o 31.64463 0.7127309   65.24556    84.7   10.01402 0.4510822          ?        ? 
1 1 1   12    5    5 o 237.4638 1.823599   191.6195   221.0   563.9730 8.660777          ?        ? 
1 1 1   12    5    6 o 119.7768 1.167468   137.8370    69.4   143.4742 2.796710          ?        ? 
1 1 1   12    5    7 o 307.9066 2.241445   445.0863   147.8   948.3552 13.80311          ?        ? 
1 1 1   12    5    8 o 105.0644 1.001791   71.36375    42.7   110.3948 2.105050          ?        ? 
1 1 1   12    5    9 f 115.5284 1.249444   177.9161   188.9   133.4902 2.886926          ?        ? 
1 1 1   12    5   10 o 42.11895 0.9281759   5.600762    59.0   17.74257 0.7818757          ?        ? 
1 1 1   12    5   11 o 59.81648 0.8797952   87.53138   283.2   35.78585 1.052525          ?        ? 
1 1 1   12    5   12 o 183.3503 1.590943   226.9297     3.2   336.4171 5.833996          ?        ? 
1 1 1   12    5   13 o 55.58960 0.9737408   74.76761   142.0   30.91417 1.082597          ?        ? 
1 1 1   12    5   14 o 40.09917 1.087419   26.31613   157.1   16.08860 0.8720922          ?        ? 
1 1 1   12    5   15 o 31.43854 1.339153   31.79965   352.2   9.893736 0.8420200          ?        ? 
1 1 1   12    5   16 o 6.343939 2.948273   13.00756    80.9 -0.8119479 0.9021643          ?        ? 
1 1 1   12    5   17 o 40.55844 1.371686   56.45723   239.5   16.47953 1.112669          ?        ? 
1 1 1   12    5   18 o 89.33315 1.110876   77.87994   326.6   79.93176 1.984761          ?        ? 
1 1 1   12    5   19 o 17.70915 2.716982   32.35724   315.0   3.187647 0.9623086          ?        ? 
1 1 1   12    5   20 o 45.59578 1.319076   34.96549    23.8   20.90014 1.202886          ?        ? 
1 1 1   12    5   21 o 22.13880 2.241271   29.05868     6.2   5.022048 0.9923807          ?        ? 
1 1 1   12    5   22 o 7.828629 3.402987   17.72876   174.5      -0.03 0.9923807          ?        ? 
1 1 1   12    5   23 o 20.61966 2.989763   16.65047   134.2   4.601038 1.232958          ?        ? 
1 1 1   12    6    0 o 17.74612 2.081904   109.1479   180.0   3.277864 0.7217315   3.277864 0.7217315 
1 1 1   12    6    1 o 215.8591 1.692662   213.5435    21.7   465.9980 7.307531          ?        ? 
1 1 1   12    6    2 o 663.9638 4.415955   785.9762   288.4   4411.433 58.64068          ?        ? 
1 1 1   12    6    3 o 159.8364 1.335818   257.0250   183.7   255.4929 4.270245          ?        ? 
1 1 1   12    6    4 o 82.05475 0.7879509   89.53374   334.5   67.33153 1.293102          ?        ? 
1 1 1   12    6    5 o 146.1155 1.255446   28.60019   332.4   213.5122 3.668802          ?        ? 
1 1 1   12    6    6 o 319.4334 2.508888   371.9064   307.9   1020.709 16.02845          ?        ? 
1 1 1   12    6    7 o 54.75386 1.043526   139.9660   142.6   29.98193 1.142741          ?        ? 
1 1 1   12    6    8 o 172.2960 1.631927   211.8206   180.3   296.9324 5.623491          ?        ? 
1 1 1   12    6    9 o 137.1534 1.567703   190.4352   137.2   188.1614 4.300317          ?        ? 
1 1 1   12    6   10 o 169.7692 1.523365   171.8266    10.3   288.3317 5.172409          ?        ? 
1 1 1   12    6   11 o 197.2576 1.753188   228.4023   335.3   389.3741 6.916593          ?        ? 
1 1 1   12    6   12 o 88.60886 1.170864   116.8187    94.4   78.54845 2.074978          ?        ? 
1 1 1   12    6   13 o 111.8968 1.155620   112.8815   327.1   125.2806 2.586205          ?        ? 
1 1 1   12    6   14 o 71.62852 1.049587   99.23583   271.8   51.33315 1.503607          ?        ? 
1 1 1   12    6   15 o 109.6964 1.069146   124.6597   271.0   120.4089 2.345627          ?        ? 
1 1 1   12    6   16 o 25.92941 1.681666   53.12583   265.5   6.736160 0.8720922          ?        ? 
1 1 1   12    6   17 o 92.31450 1.075000   108.9744   132.4   85.31468 1.984761          ?        ? 
1 1 1   12    6   18 o 72.85754 1.073157   81.17256   102.4   53.16755 1.563751          ?        ? 
1 1 1   12    6   19 o 13.84439 3.643071   12.53592   240.6   2.044906 1.022453          ?        ? 
1 1 1   12    6   20 o 37.62543 1.478614   45.05772   276.5   14.25420 1.112669          ?        ? 
1 1 1   12    6   21 f 27.08418 2.220643   25.78634   241.9   7.518036 1.202886          ?        ? 
1 1 1   12    6   22 o 6.301742 3.018929   3.718719   358.0  -1.353247 1.082597          ?        ? 
1 1 1   12    6   23 o 10.10544 3.971953   15.16156   273.3  0.9021643 1.172814          ?        ? 
1 1 1   12    7    0 o 364.7708 3.681842   451.0825     0.0   1331.294 26.85443   1331.294 26.85443 
1 1 1   12    7    1 o 169.7798 1.408139   207.8842   334.8   288.2716 4.781471          ?        ? 
1 1 1   12    7    2 o 314.7812 2.311910   308.6346    28.3   991.0576 14.55492          ?        ? 
1 1 1   12    7    3 o 334.5069 2.404823   360.0222   349.6   1119.195 16.08860          ?        ? 
1 1 1   12    7    4 o 244.0486 1.675819   337.2793   164.2   595.6691 8.179624          ?        ? 
1 1 1   12    7    5 o 414.2083 2.617284   537.0213   130.0   1716.217 21.68202          ?        ? 
1 1 1   12    7    6 o 234.7498 1.959975   226.6186   187.9   551.1923 9.202076          ?        ? 
1 1 1   12    7    7 o 129.3683 1.324987   100.9575   277.4   167.3815 3.428224          ?        ? 
1 1 1   12    7    8 o 37.87105 1.270507   58.30014   328.3   14.34441 0.9623086          ?        ? 
1 1 1   12    7    9 o 99.49094 1.057910   134.2010   288.9   98.99751 2.105050          ?        ? 
1 1 1   12    7   10 o 207.0005 1.786891   199.0038   277.9   428.7386 7.397748          ?        ? 
1 1 1   12    7   11 o 186.0729 1.648471   229.0779   215.6   346.4612 6.134717          ?        ? 
1 1 1   12    7   12 o 111.8742 1.236495   131.3923   219.6   125.2204 2.766637          ?        ? 
1 1 1   12    7   13 o 63.98371 1.057493   86.03123   179.7   40.95826 1.353247          ?        ? 
1 1 1   12    7   14 o 44.33213 1.221007   50.79665     1.4   19.66718 1.082597          ?        ? 
1 1 1   12    7   15 o 14.97690 3.301458   23.26882    19.6   2.345627 0.9623086          ?        ? 
1 1 1   12    7   16 o 133.7710 1.337579   148.4403   337.6   179.1698 3.578585          ?        ? 
1 1 1   12    7   17 o 57.71423 1.120263   71.38971    27.3   33.35001 1.293102          ?        ? 
1 1 1   12    7   18 o 25.40455 2.071529   35.26827   181.8   6.495584 1.052525          ?        ? 
1 1 1   12    7   19 o 51.46337 1.285550   58.65854   114.1   26.58378 1.323174          ?        ? 
1 1 1   12    7   20 o 41.33089 1.455190   36.30317   340.2   17.20127 1.202886          ?        ? 
1 1 1   12    7   21 o 12.16270 3.859635   13.01119    71.5   1.593824 1.052525          ?        ? 
1 1 1   12    7   22 o 34.05039 1.942965   46.27219   355.7   11.87850 1.323174          ?        ? 
1 1 1   12    7   23 o 14.35661 4.159162   27.23810   351.2   2.495988 1.263030          ?        ? 
1 1 1   12    8    0 o 145.5013 1.902181   114.7087   360.0   211.8282 5.533275   211.8282 5.533275 
1 1 1   12    8    1 o 480.1758 3.381878   569.9313   159.8   2306.624 32.47792          ?        ? 
1 1 1   12    8    2 o 93.65746 0.9953681   80.44956   203.2   87.72045 1.864473          ?        ? 
1 1 1   12    8    3 o 343.5090 2.298030   397.5877    52.5   1180.241 15.78788          ?        ? 
1 1 1   12    8    4 o 152.4993 1.311349   234.6986   158.7   232.5780 3.999595          ?        ? 
1 1 1   12    8    5 o 361.6607 2.506978   425.8610   188.4   1308.379 18.13350          ?        ? 
1 1 1   12    8    6 o 310.1066 2.472826   299.8603   327.3   962.0079 15.33679          ?        ? 
1 1 1   12    8    7 o 176.1823 1.630068   233.2820    33.7   310.4648 5.743780          ?        ? 
1 1 1   12    8    8 o 164.0742 1.521256   210.1636    35.0   269.2660 4.991976          ?        ? 
1 1 1   12    8    9 o 118.9384 1.188339   141.5639   180.9   141.4894 2.826782          ?        ? 
1 1 1   12    8   10 o 131.0643 1.307841   125.5562   140.0   171.8322 3.428224          ?        ? 
1 1 1   12    8   11 o 98.20477 1.102388   117.8418   310.2   96.47144 2.165194          ?        ? 
1 1 1   12    8   12 o 32.84900 1.235879   55.79016   344.6   10.79590 0.8119479          ?        ? 
1 1 1   12    8   13 o 42.74816 1.160729   64.80223   342.7   18.28386 0.9923807          ?        ? 
1 1 1   12    8   14 o 39.71935 1.211385   43.39580   302.2   15.78788 0.9623086          ?        ? 
1 1 1   12    8   15 o 105.2910 1.285245   98.45796   264.7   110.9662 2.706493          ?        ? 
1 1 1   12    8   16 o 103.3026 1.440981   120.0249    77.6   106.8764 2.977142          ?        ? 
1 1 1   12    8   17 f 48.70365 1.234903   35.02112   339.0   23.75699 1.202886          ?        ? 
1 1 1   12    8   18 o 69.31377 1.171409   75.49152    21.6   48.14550 1.623896          ?        ? 
1 1 1   12    8   19 o 50.92746 1.328602   56.72619   202.4   26.04248 1.353247          ?        ? 
1 1 1   12    8   20 o 20.56491 2.632147   29.89265    85.5   4.330389 1.082597          ?        ? 
1 1 1   12    8   21 o 28.56752 2.000071   24.98299   267.8   8.329985 1.142741          ?        ? 
1 1 1   12    8   22 o 15.45670 3.968441   11.90776   214.0   2.736565 1.232958          ?        ? 
1 1 1   12    8   23 o 7.776340 3.547043   3.792015   130.9 -0.4510822 1.232958          ?        ? 
1 1 1   12    9    0 o 130.8149 2.427133   239.2475   180.0   171.3210 6.345222   171.3210 6.345222 
1 1 1   12    9    1 o 192.3677 1.766488   204.6705   108.4   370.0979 6.796305          ?        ? 
1 1 1   12    9    2 o 73.01734 1.091401   50.37914   194.0   53.31791 1.593824          ?        ? 
1 1 1   12    9    3 o 447.9922 3.181795   503.6817   213.6   2007.857 28.50839          ?        ? 
1 1 1   12    9    4 o 403.4724 2.780093   419.5666   164.1   1628.467 22.43382          ?        ? 
1 1 1   12    9    5 f 73.05871 0.9055555   69.44141   103.3   53.37806 1.323174          ?        ? 
1 1 1   12    9    6 o 143.1930 1.239067   166.7357    46.3   205.0620 3.548513          ?        ? 
1 1 1   12    9    7 o 117.9018 1.122268   137.7282   176.7   139.0235 2.646349          ?        ? 
1 1 1   12    9    8 o 15.89145 1.608496   44.90755    11.0   2.526060 0.5112265          ?        ? 
1 1 1   12    9    9 o 130.0726 1.040378   141.9712   202.7   169.2160 2.706493          ?        ? 
1 1 1   12    9   10 o 40.96100 0.8442901   56.57212   147.7   16.78026 0.6916593          ?        ? 
1 1 1   12    9   11 o 73.50480 0.8591481   59.54629   100.8   54.03964 1.263030          ?        ? 
1 1 1   12    9   12 o 104.3919 0.9938404   154.5567    66.2   109.0115 2.074978          ?        ? 
1 1 1   12    9   13 o 108.5001 1.205656   159.0079   214.1   117.7926 2.616277          ?        ? 
1 1 1   12    9   14 o 54.07295 1.140087   63.35317   340.9   29.26020 1.232958          ?        ? 
1 1 1   12    9   15 o 98.01619 1.303934   99.02589   313.7   96.17072 2.556132          ?        ? 
1 1 1   12    9   16 o 46.72269 1.383806   53.61779    39.2   21.86245 1.293102          ?        ? 
1 1 1   12    9   17 o 17.47048 3.304725   19.32550   333.0   3.187647 1.112669          ?        ? 
1 1 1   12    9   18 o 60.95851 1.109973   54.94263    79.3   37.22932 1.353247          ?        ? 
1 1 1   12    9   19 o 7.232543 3.279386   15.76937   152.2 -0.5412986 1.022453          ?        ? 
1 1 1   12    9   20 o 24.15844 2.365098   20.93423   130.0   5.954284 1.142741          ?        ? 
1 1 1   12    9   21 o 12.05576 4.030096   13.53014   130.1   1.533679 1.142741          ?        ? 
1 1 1   12    9   22 o 13.22449 3.785641   8.875166   120.5   1.984761 1.052525          ?        ? 
1 1 1   12    9   23 o 15.38758 3.978167   21.29181   205.3   2.886926 1.232958          ?        ? 
1 1 1   12   10    0 f 258.4772 3.439315   349.3965    -0.0   668.6240 17.77264   668.6240 17.77264 
1 1 1   12   10    1 o 47.64752 1.293832   124.4128   156.2   22.70447 1.232958          ?        ? 
1 1 1   12   10    2 o 387.1163 3.095646   483.8320    40.9   1499.217 23.96750          ?        ? 
1 1 1   12   10    3 o 177.0086 1.495039   166.0964   196.1   313.3517 5.292697          ?        ? 
1 1 1   12   10    4 o 398.2332 2.839323   371.9019   327.7   1586.516 22.61425          ?        ? 
1 1 1   12   10    5 o 426.5774 2.996095   497.1382   350.5   1820.628 25.56132          ?        ? 
1 1 1   12   10    6 o 351.1688 2.526217   386.8182   160.1   1233.740 17.74257          ?        ? 
1 1 1   12   10    7 f 277.0391 1.905024   300.0023   262.8   767.7720 10.55532          ?        ? 
1 1 1   12   10    8 o 46.98034 0.7681208   68.62513   348.5   22.07295 0.7217315          ?        ? 
1 1 1   12   10    9 o 110.5825 0.9518008   153.8210   142.5   122.3034 2.105050          ?        ? 
1 1 1   12   10   10 o 83.42972 0.9191446   74.82278   138.8   69.61701 1.533679          ?        ? 
1 1 1   12   10   11 o 118.5135 1.065727   126.0256   279.1   140.4971 2.526060          ?        ? 
1 1 1   12   10   12 o 45.84114 0.9184109   91.09863    83.2   21.02043 0.8420200          ?        ? 
1 1 1   12   10   13 o 15.97086 2.165379   16.89581    99.6   2.556132 0.6916593          ?        ? 
1 1 1   12   10   14 o 60.10585 0.9506076   59.92062   293.4   36.14672 1.142741          ?        ? 
1 1 1   12   10   15 o 65.15663 1.176917   74.19075    70.0   42.49194 1.533679          ?        ? 
1 1 1   12   10   16 o 74.96516 1.203445   64.01363   140.6   56.26498 1.804329          ?        ? 
1 1 1   12   10   17 o 38.75569 1.590680   48.88504    79.4   15.06614 1.232958          ?        ? 
1 1 1   12   10   18 o 11.19820 3.864852   11.39338   198.3   1.172814 1.052525          ?        ? 
1 1 1   12   10   19 o 27.45008 1.917162   17.63398    46.2   7.608253 1.052525          ?        ? 
1 1 1   12   10   20 o 59.72273 1.258823   67.83596   170.2   35.87607 1.503607          ?        ? 
1 1 1   12   10   21 o 18.61506 2.746307   19.86600   211.7   3.608657 1.022453          ?        ? 
1 1 1   12   10   22 o 9.199388 3.807692   5.539911    85.8  0.4510822 1.142741          ?        ? 
1 1 1   12   10   23 o 15.84192 3.832637   11.11440   228.0   3.037287 1.202886          ?        ? 
1 1 1   12   11    0 o 283.5201 3.703157   336.8758     0.0   804.4900 20.99036   804.4900 20.99036 
1 1 1   12   11    1 o 207.0821 2.171017   255.0112     3.3   428.9190 8.991571          ?        ? 
1 1 1   12   11    2 o 178.8318 1.656364   204.3356   117.5   319.8473 5.924213          ?        ? 
1 1 1   12   11    3 o 406.0848 3.143586   385.9556    16.1   1649.818 25.53125          ?        ? 
1 1 1   12   11    4 o 189.2856 1.588718   148.7009    48.3   358.3397 6.014429          ?        ? 
1 1 1   12   11    5 o 292.8762 2.181923   311.3984     6.8   858.0184 12.78066          ?        ? 
1 1 1   12   11    6 o 176.2012 1.493357   167.2133   203.0   310.5250 5.262625          ?        ? 
1 1 1   12   11    7 o 171.4796 1.341570   205.4324   323.7   294.1056 4.601038          ?        ? 
1 1 1   12   11    8 o 191.6046 1.388999   288.6762   342.6   367.2109 5.322770          ?        ? 
1 1 1   12   11    9 o 105.7592 0.9525571   155.0612    76.1   111.8684 2.014834          ?        ? 
1 1 1   12   11   10 o 77.95035 0.9644647   62.29327   148.0   60.77581 1.503607          ?        ? 
1 1 1   12   11   11 f 51.84388 0.8990805   16.50574   137.1   26.88450 0.9322364          ?        ? 
1 1 1   12   11   12 o 124.5716 1.122531   152.5237   299.9   155.2625 2.796710          ?        ? 
1 1 1   12   11   13 o 95.72994 1.036646   74.82576   159.9   91.68996 1.984761          ?        ? 
1 1 1   12   11   14 o 45.04013 1.034895   62.83281    73.6   20.29870 0.9322364          ?        ? 
1 1 1   12   11   15 o 37.97281 1.267102   48.60527   338.8   14.43463 0.9623086          ?        ? 
1 1 1   12   11   16 o 48.77295 1.171491   46.90266   185.2   23.81714 1.142741          ?        ? 
1 1 1   12   11   17 o 21.07404 2.711254   21.51889   208.9   4.480750 1.142741          ?        ? 
1 1 1   12   11   18 o 47.01309 1.471206   58.13263   203.8   22.19324 1.383319          ?        ? 
1 1 1   12   11   19 o 35.76109 1.513652   36.18694    52.8   12.87088 1.082597          ?        ? 
1 1 1   12   11   20 o 17.05679 3.381891   23.71922   187.2   3.127503 1.112669          ?        ? 
1 1 1   12   11   21 o 10.85266 3.853024   11.05968   207.2   1.172814 1.052525          ?        ? 
1 1 1   12   11   22 o 51.48273 1.431096   48.39479    85.5   26.94464 1.473535          ?        ? 
1 1 1   12   11   23 f 17.20595 3.442390   14.70705    92.1   3.458297 1.142741          ?        ? 
1 1 1   12   12    0 o 16.47635 5.377683   29.60378   180.0   3.458297 1.563751   3.458297 1.563751 
1 1 1   12   12    1 o 236.6520 2.090356   286.1099    72.7   560.1538 9.893736          ?        ? 
1 1 1   12   12    2 f 604.3491 4.625151   588.0496   214.6   3656.141 55.90411          ?        ? 
1 1 1   12   12    3 o 102.7939 1.170192   147.9586    16.8   105.6735 2.405771          ?        ? 
1 1 1   12   12    4 o 292.4630 2.524323   314.9537   291.8   855.6728 14.76542          ?        ? 
1 1 1   12   12    5 o 114.5648 1.233705   105.6440   241.0   131.2649 2.826782          ?        ? 
1 1 1   12   12    6 o 315.3100 2.079137   349.2839   175.3   994.6061 13.11145          ?        ? 
1 1 1   12   12    7 f 65.36748 0.8740903   63.01338    84.8   42.73252 1.142741          ?        ? 
1 1 1   12   12    8 o 87.68396 0.9259937   71.14547     9.7   76.89447 1.623896          ?        ? 
1 1 1   12   12    9 o 111.8380 0.9948939   162.6219    55.3   125.1001 2.225339          ?        ? 
1 1 1   12   12   10 o 117.4682 1.113611   128.8657   165.5   138.0311 2.616277          ?        ? 
1 1 1   12   12   11 o 139.0330 1.211252   174.3743   213.6   193.3940 3.368080          ?        ? 
1 1 1   12   12   12 o 101.4796 1.037179   132.1921   357.2   103.0272 2.105050          ?        ? 
1 1 1   12   12   13 o 48.63734 0.9892694   70.76544    86.0   23.66678 0.9623086          ?        ? 
1 1 1   12   12   14 o 44.77200 1.074677   48.54466   270.1   20.05812 0.9623086          ?        ? 
1 1 1   12   12   15 o 83.71449 1.005824   99.01458   110.0   70.12824 1.684040          ?        ? 
1 1 1   12   12   16 o 27.27126 1.709192   43.45084    18.8   7.457891 0.9322364          ?        ? 
1 1 1   12   12   17 o 35.02532 1.459591   36.98321   104.0   12.29951 1.022453          ?        ? 
1 1 1   12   12   18 o 27.36320 2.362849   27.05241   186.0   7.578181 1.293102          ?        ? 
1 1 1   12   12   19 o 20.40964 2.946857   29.66618   346.7   4.270245 1.202886          ?        ? 
1 1 1   12   12   20 o 18.96017 3.013533   21.86107   210.8   3.728946 1.142741          ?        ? 
1 1 1   12   12   21 o 50.78256 1.391611   54.05245   318.0   26.10262 1.413391          ?        ? 
1 1 1   12   12   22 o 15.55200 3.718744   21.25940   281.6   2.796710 1.142741          ?        ? 
1 1 1   12   12   23 o 22.74990 2.643716   23.49776   246.1   5.623491 1.202886          ?        ? 
1 1 1   12   13    0 o 168.7924 2.513310   133.5109   180.0   285.1441 8.480345   285.1441 8.480345 
1 1 1   12   13    1 o 257.1674 2.262712   300.8514    44.4   661.5270 11.63792          ?        ? 
1 1 1   12   13    2 o 321.4812 2.768857   411.0530    63.7   1033.940 17.80271          ?        ? 
1 1 1   12   13    3 o 199.9029 1.797683   146.0220   110.5   399.6889 7.187243          ?        ? 
1 1 1   12   13    4 o 303.0564 2.535314   272.8475   101.6   918.8243 15.36687          ?        ? 
1 1 1   12   13    5 o 341.8720 2.669683   420.7520   125.5   1169.476 18.25379          ?        ? 
1 1 1   12   13    6 o 404.5303 2.858312   486.9166    26.1   1637.789 23.12548          ?        ? 
1 1 1   12   13    7 o 40.66663 0.9982975   19.94712   199.2   16.53968 0.8119479          ?        ? 
1 1 1   12   13    8 o 146.1430 1.224344   186.9324   265.4   213.6325 3.578585          ?        ? 
1 1 1   12   13    9 o 26.52340 1.190487   15.76610   323.3   7.036882 0.6315150          ?        ? 
1 1 1   12   13   10 o 36.78158 1.021984   39.56551   206.9   13.53246 0.7518036          ?        ? 
1 1 1   12   13   11 o 39.87930 0.9425989   51.54051   141.1   15.90816 0.7518036          ?        ? 
1 1 1   12   13   12 o 75.95351 0.9106352   93.27150   236.1   57.70844 1.383319          ?        ? 
1 1 1   12   13   13 o 45.93422 1.014752   54.04528   130.7   21.11065 0.9322364          ?        ? 
1 1 1   12   13   14 o 17.91211 2.266478   20.20383    93.8   3.217719 0.8119479          ?        ? 
1 1 1   12   13   15 o 98.03759 1.134942   122.3885    60.6   96.20079 2.225339          ?        ? 
1 1 1   12   13   16 o 64.94065 1.088217   64.02732    31.4   42.22129 1.413391          ?        ? 
1 1 1   12   13   17 o 63.11772 1.095824   73.93259   151.0   39.90574 1.383319          ?        ? 
1 1 1   12   13   18 o 30.28275 1.737829   40.37971   312.6   9.232149 1.052525          ?        ? 
1 1 1   12   13   19 o 28.03552 1.823496   30.33124   323.2   7.939046 1.022453          ?        ? 
1 1 1   12   13   20 o 11.07870 3.810625   16.12492   198.2   1.232958 1.022453          ?        ? 
1 1 1   12   13   21 o 18.10187 2.990290   24.31215   216.1   3.458297 1.082597          ?        ? 
1 1 1   12   13   22 o 11.60032 3.922613   11.35441   159.9   1.503607 1.082597          ?        ? 
1 1 1   12   13   23 o 9.084343 3.786773   13.40646    68.2  0.5713707 1.142741          ?        ? 
1 1 1   12   14    0 o 253.2530 2.862539   177.4109   180.0   641.7697 14.49477   641.7697 14.49477 
1 1 1   12   14    1 o 139.5430 1.465431   98.49044   356.9   194.7472 4.089812          ?        ? 
1 1 1   12   14    2 f 75.18686 1.199896   119.1477   185.9   56.53563 1.804329          ?        ? 
1 1 1   12   14    3 o 135.9290 1.460145   151.4736   123.1   184.7933 3.969523          ?        ? 
1 1 1   12   14    4 o 35.78946 1.344402   68.30092   347.8   12.81073 0.9623086          ?        ? 
1 1 1   12   14    5 o 132.7140 1.382221   148.2418   132.9   176.1626 3.668802          ?        ? 
1 1 1   12   14    6 o 68.44510 1.010532   14.97757   358.5   46.85240 1.383319          ?        ? 
1 1 1   12   14    7 o 170.6348 1.445143   194.0270   142.7   291.2487 4.931832          ?        ? 
1 1 1   12   14    8 o 206.5571 1.543228   213.7124   120.4   426.8440 6.375295          ?        ? 
1 1 1   12   14    9 o 64.43711 0.9100453   77.21560   100.6   41.52963 1.172814          ?        ? 
1 1 1   12   14   10 o 171.0115 1.450751   207.0643    34.1   292.6320 4.961904          ?        ? 
1 1 1   12   14   11 o 125.4369 1.174723   158.8925    70.8   157.4277 2.947070          ?        ? 
1 1 1   12   14   12 o 90.52096 0.9800253   120.4191   124.5   81.97667 1.774257          ?        ? 
1 1 1   12   14   13 o 61.70973 0.9502665   65.55520   293.1   38.10141 1.172814          ?        ? 
1 1 1   12   14   14 o 60.70000 1.015616   64.66535   140.2   36.86845 1.232958          ?        ? 
1 1 1   12   14   15 o 44.39146 1.185504   47.81264   164.7   19.72733 1.052525          ?        ? 
1 1 1   12   14   16 o 19.17697 2.352208   27.12000    66.1   3.698874 0.9021643          ?        ? 
1 1 1   12   14   17 o 35.05615 1.458308   31.62794   170.3   12.32958 1.022453          ?        ? 
1 1 1   12   14   18 o 39.83866 1.358727   48.25117   258.2   15.93824 1.082597          ?        ? 
1 1 1   12   14   19 o 44.17268 1.395612   47.51965   114.2   19.63711 1.232958          ?        ? 
1 1 1   12   14   20 o 4.909031 2.445809   8.628782   342.0  -2.405771 0.9623086          ?        ? 
1 1 1   12   14   21 o 14.08583 3.612266   15.67955   324.0   2.225339 1.022453          ?        ? 
1 1 1   12   14   22 o 10.26160 3.985350   16.62808   334.5  0.9623086 1.172814          ?        ? 
1 1 1   12   15    0 o 217.5211 2.579163   143.9036   180.0   473.4558 11.21691   473.4558 11.21691 
1 1 1   12   15    1 o 444.1260 3.124855   416.3268   250.7   1973.755 27.75659          ?        ? 
1 1 1   12   15    2 o 286.8408 2.468962   268.4695   329.1   823.1347 14.16398          ?        ? 
1 1 1   12   15    3 o 167.4939 1.624853   205.7198   264.1   280.6032 5.443058          ?        ? 
1 1 1   12   15    4 o 210.9583 1.903045   210.6806   148.7   445.1880 8.029263          ?        ? 
1 1 1   12   15    5 o 254.2894 1.939456   328.3394   202.8   646.8820 9.863664          ?        ? 
1 1 1   12   15    6 o 227.3627 1.831871   296.8399    13.3   517.1506 8.329985          ?        ? 
1 1 1   12   15    7 o 195.4281 1.638804   254.1431   299.6   382.0966 6.405366          ?        ? 
1 1 1   12   15    8 o 169.9189 1.468929   201.1949   353.8   288.8430 4.991976          ?        ? 
1 1 1   12   15    9 o 244.8928 1.946335   275.4048   246.2   600.3001 9.532870          ?        ? 
1 1 1   12   15   10 o 70.51693 0.8955510   109.3075   269.4   49.73933 1.263030          ?        ? 
1 1 1   12   15   11 f 112.8093 1.106286   147.5137   216.8   127.3255 2.495988          ?        ? 
1 1 1   12   15   12 f 62.17421 0.9431673   74.43812   136.0   38.67278 1.172814          ?        ? 
1 1 1   12   15   13 o 56.01479 1.020036   61.56665   188.1   31.39532 1.142741          ?        ? 
1 1 1   12   15   14 o 33.33657 1.353115   45.95819    24.7   11.12669 0.9021643          ?        ? 
1 1 1   12   15   15 o 64.01519 1.056973   57.05830   123.5   41.01840 1.353247          ?        ? 
1 1 1   12   15   16 o 11.88194 3.607187   17.23203    41.3   1.443463 0.9322364          ?        ? 
1 1 1   12   15   17 o 23.11808 2.146331   29.82505    77.1   5.382914 0.9923807          ?        ? 
1 1 1   12   15   18 o 44.62796 1.280298   47.28225    58.7   19.99798 1.142741          ?        ? 
1 1 1   12   15   19 o 62.89068 1.195413   78.56265   121.9   39.75537 1.503607          ?        ? 
1 1 1   12   15   20 o 20.21914 2.677160   22.27943   145.0   4.240172 1.082597          ?        ? 
1 1 1   12   15   21 o 14.17642 3.513395   16.74154    22.6   2.255411 0.9923807          ?        ? 
1 1 1   12   15   22 o 22.86032 2.630947   24.99251   328.7   5.593419 1.202886          ?        ? 
1 1 1   12   16    0 o 330.3116 3.469549   419.2366   180.0   1091.950 22.91497   1091.950 22.91497 
1 1 1   12   16    1 o 229.1481 1.863531   260.4731   262.6   525.2401 8.540489          ?        ? 
1 1 1   12   16    2 o 268.5818 2.076977   248.8573   206.6   721.6412 11.15676          ?        ? 
1 1 1   12   16    3 o 78.29951 1.229010   87.47632    79.8   61.31710 1.924617          ?        ? 
1 1 1   12   16    4 o 71.17886 1.182964   75.51071   228.3   50.67156 1.684040          ?        ? 
1 1 1   12   16    5 o 130.4756 1.233073   166.8891   243.5   170.2685 3.217719          ?        ? 
1 1 1   12   16    6 o 17.33400 2.342068   34.57156    49.5   3.007215 0.8119479          ?        ? 
1 1 1   12   16    7 o 218.7138 1.759942   216.0989   134.6   478.6282 7.698469          ?        ? 
1 1 1   12   16    8 o 91.89651 1.079889   146.4891   355.0   84.47266 1.984761          ?        ? 
1 1 1   12   16    9 o 264.6779 2.221230   271.1662    33.8   701.4929 11.75821          ?        ? 
1 1 1   12   16   10 o 78.08305 0.9050561   123.9535   280.7   60.98631 1.413391          ?        ? 
1 1 1   12   16   11 o 65.51877 0.9638689   79.27410   285.3   42.94302 1.263030          ?        ? 
1 1 1   12   16   12 o 107.7766 1.116092   129.3581   289.2   116.2288 2.405771          ?        ? 
1 1 1   12   16   13 o 104.3047 1.052334   115.2926   255.7   108.8612 2.195267          ?        ? 
1 1 1   12   16   14 o 32.32742 1.441866   47.97945   102.1   10.46511 0.9322364          ?        ? 
1 1 1   12   16   15 o 82.04569 1.099588   90.32388   226.1   67.39168 1.804329          ?        ? 
1 1 1   12   16   16 o 69.36175 1.062210   68.42716   108.3   48.17558 1.473535          ?        ? 
1 1 1   12   16   17 o 49.79876 1.207747   54.47832   218.7   24.86966 1.202886          ?        ? 
1 1 1   12   16   18 o 18.88379 2.707224   29.58191   130.3   3.638730 1.022453          ?        ? 
1 1 1   12   16   19 o 54.34502 1.162048   63.61861   183.8   29.68121 1.263030          ?        ? 
1 1 1   12   16   20 o 53.85108 1.200628   56.48873   250.2   29.23012 1.293102          ?        ? 
1 1 1   12   16   21 o 26.60777 2.090873   27.55500   200.4   7.307531 1.112669          ?        ? 
1 1 1   12   16   22 o 16.33232 3.507309   23.23100   145.0   3.127503 1.112669          ?        ? 
1 1 1   12   17    0 o 334.6018 3.591412   302.2315    -0.0   1120.669 24.02764   1120.669 24.02764 
1 1 1   12   17    1 o 180.7253 1.655650   222.8386   195.9   326.7038 5.984357          ?        ? 
1 1 1   12   17    2 o 306.1927 2.376758   299.4362   262.4   938.0704 14.55492          ?        ? 
1 1 1   12   17    3 f 370.1776 3.095133   379.9312   189.0   1371.681 22.91497          ?        ? 
1 1 1   12   17    4 o 24.64193 1.830547   48.99791   174.3   6.074574 0.9021643          ?        ? 
1 1 1   12   17    5 o 110.8244 1.166803   134.0437   162.5   122.8447 2.586205          ?        ? 
1 1 1   12   17    6 o 265.2541 2.012337   274.7973   281.5   704.1092 10.67561          ?        ? 
1 1 1   12   17    7 o 18.26258 2.058317   45.21161   336.1   3.338008 0.7518036          ?        ? 
1 1 1   12   17    8 o 90.37717 1.114681   142.2479   260.9   81.70602 2.014834          ?        ? 
1 1 1   12   17    9 o 53.07205 1.104926   54.33394   230.4   28.17760 1.172814          ?        ? 
1 1 1   12   17   10 o 110.2070 1.132409   124.6095   216.9   121.5215 2.495988          ?        ? 
1 1 1   12   17   11 o 48.94467 1.013778   48.48350   257.2   23.96750 0.9923807          ?        ? 
1 1 1   12   17   12 o 102.0805 1.178370   130.9958    10.0   104.2902 2.405771          ?        ? 
1 1 1   12   17   13 o 83.22714 1.083979   76.11993   102.1   69.31629 1.804329          ?        ? 
1 1 1   12   17   14 o 77.65856 1.026174   77.72173   141.7   60.35479 1.593824          ?        ? 
1 1 1   12   17   15 o 45.22062 1.230268   58.39084   258.9   20.47913 1.112669          ?        ? 
1 1 1   12   17   16 o 22.67766 2.055407   33.00928   110.1   5.172409 0.9322364          ?        ? 
1 1 1   12   17   17 o 66.24201 1.089537   86.26476   161.0   43.99555 1.443463          ?        ? 
1 1 1   12   17   18 o 39.14174 1.306090   37.21808    45.0   15.39694 1.022453          ?        ? 
1 1 1   12   17   19 o 23.56594 2.105540   25.71628   202.5   5.653563 0.9923807          ?        ? 
1 1 1   12   17   20 o 7.430968 3.350479   11.68679   272.5 -0.3909379 1.052525          ?        ? 
1 1 1   12   17   21 o 11.62926 3.867743   8.245077   349.9   1.503607 1.052525          ?        ? 
1 1 1   12   17   22 o 9.923954 3.794004   6.519371   291.8  0.9923807 1.052525          ?        ? 
1 1 1   12   18    0 o 36.27493 2.086941   77.08772     0.0   13.29189 1.503607   13.29189 1.503607 
1 1 1   12   18    1 o 227.3931 1.891138   194.4757   328.3   517.2709 8.600634          ?        ? 
1 1 1   12   18    2 o 391.0332 2.856996   353.0302    86.2   1530.432 22.34361          ?        ? 
1 1 1   12   18    3 o 362.4523 2.671588   393.8991   342.0   1314.844 19.36646          ?        ? 
1 1 1   12   18    4 o 105.1442 1.172635   151.4139   319.7   110.5753 2.465916          ?        ? 
1 1 1   12   18    5 o 134.4717 1.341790   132.7451   277.1   180.8840 3.608657          ?        ? 
1 1 1   12   18    6 f 174.7641 1.557259   141.9584   253.4   305.5630 5.443058          ?        ? 
1 1 1   12   18    7 o 223.6291 1.842284   254.5949   298.0   500.5208 8.239767          ?        ? 
1 1 1   12   18    8 o 116.7174 1.223834   140.9882    88.3   136.2870 2.856854          ?        ? 
1 1 1   12   18    9 o 145.4393 1.323313   167.1427   138.0   211.6478 3.849235          ?        ? 
1 1 1   12   18   10 o 9.442039 3.324043   18.78304    91.8  0.7818757 0.7818757          ?        ? 
1 1 1   12   18   11 o 129.7237 1.240220   159.5538   254.1   168.4040 3.217719          ?        ? 
1 1 1   12   18   12 o 59.72598 1.082529   82.29754   134.4   35.69564 1.293102          ?        ? 
1 1 1   12   18   13 o 63.99857 1.057248   75.82135    73.9   40.98833 1.353247          ?        ? 
1 1 1   12   18   14 o 35.51073 1.397297   29.23651   352.7   12.63030 0.9923807          ?        ? 
1 1 1   12   18   15 o 47.86291 1.193765   59.91377   294.7   22.94505 1.142741          ?        ? 
1 1 1   12   18   16 o 42.56289 1.307088   43.82799   314.7   18.16358 1.112669          ?        ? 
1 1 1   12   18   17 o 22.63409 2.059364   28.67389   333.5   5.172409 0.9322364          ?        ? 
1 1 1   12   18   18 o 25.96860 1.968633   23.22495    45.9   6.826377 1.022453          ?        ? 
1 1 1   12   18   19 o 21.58932 2.576898   15.05245   327.3   4.811543 1.112669          ?        ? 
1 1 1   12   18   20 o 7.611511 3.354558   6.623331   160.0 -0.1503607 0.9923807          ?        ? 
1 1 1   12   18   21 o 5.983575 2.882747   4.739462   290.1  -1.353247 1.022453          ?        ? 
1 1 1   12   18   22 o 9.226978 3.779752   5.812174     3.4  0.6615872 1.112669          ?        ? 
1 1 1   12   19    0 o 72.05534 1.503912   13.80460   360.0   51.99474 2.165194   51.99474 2.165194 
1 1 1   12   19    1 o 188.1739 1.678009   182.7225   116.5   354.2198 6.315150          ?        ? 
1 1 1   12   19    2 o 146.8398 1.402850   138.1446   146.1   215.6774 4.119884          ?        ? 
1 1 1   12   19    3 o 210.6370 1.756042   236.5578   175.1   443.8949 7.397748          ?        ? 
1 1 1   12   19    4 o 97.03957 1.069140   99.39516   320.9   94.18596 2.074978          ?        ? 
1 1 1   12   19    5 o 229.6767 1.872335   251.4512     6.6   527.8564 8.600634          ?        ? 
1 1 1   12   19    6 f 129.9309 1.284532   138.4891   204.2   168.8852 3.338008          ?        ? 
1 1 1   12   19    7 o 164.7969 1.478089   200.0415    48.1   271.7319 4.871688          ?        ? 
1 1 1   12   19    8 o 50.45948 1.072739   62.85467    49.9   25.47111 1.082597          ?        ? 
1 1 1   12   19    9 o 46.29296 1.104329   54.55924   118.8   21.44144 1.022453          ?        ? 
1 1 1   12   19   10 o 61.73590 1.022930   78.00832   211.1   38.13148 1.263030          ?        ? 
1 1 1   12   19   11 o 53.68445 1.092322   67.73512   129.2   28.83919 1.172814          ?        ? 
1 1 1   12   19   12 o 99.95651 1.173324   108.9537   232.0   99.98988 2.345627          ?        ? 
1 1 1   12   19   13 o 128.8521 1.271948   125.0267   334.0   166.2087 3.277864          ?        ? 
1 1 1   12   19   14 o 33.68132 1.473192   20.96395    21.1   11.36727 0.9923807          ?        ? 
1 1 1   12   19   15 o 50.72479 1.156056   71.58956   250.1   25.77183 1.172814          ?        ? 
1 1 1   12   19   16 o 45.75888 1.215796   58.00878     7.6   20.99036 1.112669          ?        ? 
1 1 1   12   19   17 o 43.09816 1.221079   35.45971    56.6   18.64473 1.052525          ?        ? 
1 1 1   12   19   18 o 45.89716 1.343175   57.80664   172.4   21.20086 1.232958          ?        ? 
1 1 1   12   19   19 o 6.525926 3.054811   10.22405    80.3 -0.8720922 0.9923807          ?        ? 
1 1 1   12   19   20 o 14.83942 3.826711   16.90112   326.1   2.495988 1.142741          ?        ? 
1 1 1   12   19   21 o 27.38870 2.031256   28.11395   316.0   7.788685 1.112669          ?        ? 
1 1 1   12   20    0 o 165.2271 2.257806   280.4132   180.0   273.2656 7.457891   273.2656 7.457891 
1 1 1   12   20    1 o 132.7626 1.359064   155.6751    94.5   176.3130 3.608657          ?        ? 
1 1 1   12   20    2 o 84.16341 1.107651   102.6594   170.6   70.84998 1.864473          ?        ? 
1 1 1   12   20    3 o 195.4753 1.569180   194.4635   189.2   382.2771 6.134717          ?        ? 
1 1 1   12   20    4 o 28.11700 1.497350   26.30295   106.0   7.908974 0.8420200          ?        ? 
1 1 1   12   20    5 o 212.6928 1.597681   221.1723   217.1   452.6459 6.796305          ?        ? 
1 1 1   12   20    6 o 88.96911 1.115422   128.5034    19.5   79.17995 1.984761          ?        ? 
1 1 1   12   20    7 o 121.3802 1.325471   125.5583     5.0   147.4137 3.217719          ?        ? 
1 1 1   12   20    8 o 54.71720 1.071705   48.50274   351.3   29.95186 1.172814          ?        ? 
1 1 1   12   20    9 o 121.5605 1.274028   135.2729   339.1   147.8647 3.097431          ?        ? 
1 1 1   12   20   10 o 40.65387 1.257510   63.08677    83.5   16.53968 1.022453          ?        ? 
1 1 1   12   20   11 o 82.02779 1.081497   85.75327    37.5   67.33153 1.774257          ?        ? 
1 1 1   12   20   12 o 6.089718 2.931663   6.124169   342.5  -1.593824 1.052525          ?        ? 
1 1 1   12   20   13 o 29.85262 1.712501   40.13945    11.3   8.931427 1.022453          ?        ? 
1 1 1   12   20   14 o 86.27036 1.132886   96.54084   168.4   74.51878 1.954689          ?        ? 
1 1 1   12   20   15 o 36.68729 1.557408   32.33787   104.4   13.50239 1.142741          ?        ? 
1 1 1   12   20   16 f 25.61734 1.936932   36.81715   356.8   6.615872 0.9923807          ?        ? 
1 1 1   12   20   17 o 47.58331 1.200780   56.88902    35.9   22.73454 1.142741          ?        ? 
1 1 1   12   20   18 o 36.82625 1.551531   40.05596   258.2   13.68283 1.142741          ?        ? 
1 1 1   12   20   19 o 13.08102 3.799096   17.26410   285.5   1.894545 1.052525          ?        ? 
1 1 1   12   20   20 o 20.85907 2.667111   27.97208   163.0   4.570966 1.112669          ?        ? 
1 1 1   12   20   21 o 13.84663 3.938456   9.927161   122.2   2.315555 1.142741          ?        ? 
1 1 1   12   21    0 f 105.8935 1.761795   117.5427     0.0   112.2593 3.728946   112.2593 3.728946 
1 1 1   12   21    1 o 202.8272 1.779178   224.5464    49.9   411.6275 7.217315          ?        ? 
1 1 1   12   21    2 f 299.5384 2.329163   325.0027   342.3   898.1347 13.95348          ?        ? 
1 1 1   12   21    3 o 31.92324 1.318820   67.69707    27.3   10.19446 0.8420200          ?        ? 
1 1 1   12   21    4 f 39.91621 1.167742   99.37222   219.9   15.93824 0.9322364          ?        ? 
1 1 1   12   21    5 o 118.2719 1.106043   102.4583   306.7   139.9257 2.616277          ?        ? 
1 1 1   12   21    6 o 82.33538 1.022671   77.33653   196.3   67.81268 1.684040          ?        ? 
1 1 1   12   21    7 o 160.6666 1.590954   201.0721   198.2   258.3498 5.112265          ?        ? 
1 1 1   12   21    8 o 85.86563 1.103203   87.65600   186.0   73.76698 1.894545          ?        ? 
1 1 1   12   21    9 o 8.628347 3.453267   55.52796    54.4  0.3608657 0.9021643          ?        ? 
1 1 1   12   21   10 o 81.51521 1.069852   65.75760   179.8   66.48952 1.744184          ?        ? 
1 1 1   12   21   11 o 65.50705 1.147668   52.97093   256.5   42.94302 1.503607          ?        ? 
1 1 1   12   21   12 o 45.25660 1.428634   40.61708   147.5   20.50920 1.293102          ?        ? 
1 1 1   12   21   13 o 40.06749 1.576128   50.67166   224.3   16.08860 1.263030          ?        ? 
1 1 1   12   21   14 o 25.00179 2.165039   29.73462    78.9   6.285078 1.082597          ?        ? 
1 1 1   12   21   15 o 63.03606 1.144950   57.04992     1.1   39.81552 1.443463          ?        ? 
1 1 1   12   21   16 o 8.145135 3.439127   1.733982    57.7       0.09 0.9623086          ?        ? 
1 1 1   12   21   17 o 21.38298 2.531446   29.43653   259.8   4.661182 1.082597          ?        ? 
1 1 1   12   21   18 o 31.79972 1.796779   37.55341   109.4   10.25460 1.142741          ?        ? 
1 1 1   12   21   19 o 36.02047 1.669726   23.63111   216.2   13.20167 1.202886          ?        ? 
1 1 1   12   21   20 o 14.60058 3.781209   12.35118   129.8   2.465916 1.112669          ?        ? 
1 1 1   12   21   21 f 32.87544 1.783723   29.97806   228.4   11.21691 1.172814          ?        ? 
1 1 1   12   22    0 o 224.2227 2.730196   228.7149     0.0   503.3776 12.23936   503.3776 12.23936 
1 1 1   12   22    1 f 90.41243 1.114246   69.83432   273.1   81.76616 2.014834          ?        ? 
1 1 1   12   22    2 o 63.96472 1.175341   65.55704   351.8   40.92819 1.503607          ?        ? 
1 1 1   12   22    3 f 115.4806 1.119757   113.9922    27.4   133.4000 2.586205          ?        ? 
1 1 1   12   22    4 o 147.1159 1.267350   148.7417   212.5   216.5194 3.728946          ?        ? 
1 1 1   12   22    5 f 135.3663 1.188523   157.9365    66.8   183.3198 3.217719          ?        ? 
1 1 1   12   22    6 o 195.5322 1.661001   210.2035    33.4   382.6680 6.495584          ?        ? 
1 1 1   12   22    7 o 6.024364 2.756219   29.43443   184.0 -0.5412986 0.7518036          ?        ? 
1 1 1   12   22    8 o 70.87006 1.082036   82.26369   227.1   50.25056 1.533679          ?        ? 
1 1 1   12   22    9 o 137.8339 1.352695   149.7091   175.5   190.1462 3.728946          ?        ? 
1 1 1   12   22   10 o 100.2697 1.184655   120.1035   221.6   100.6214 2.375700          ?        ? 
1 1 1   12   22   11 o 14.77478 3.335421   26.25142   279.9   2.285483 0.9623086          ?        ? 
1 1 1   12   22   12 o 105.7557 1.194290   122.1118   235.9   111.9586 2.526060          ?        ? 
1 1 1   12   22   13 f 53.40643 1.295086   67.36300   270.4   28.56854 1.383319          ?        ? 
1 1 1   12   22   14 o 20.99878 2.792576   20.64954    87.7   4.450677 1.172814          ?        ? 
1 1 1   12   22   15 o 15.94053 3.225479   34.67235   324.8   2.676421 0.9923807          ?        ? 
1 1 1   12   22   16 o 38.00896 1.463693   41.64950   262.9   14.52485 1.112669          ?        ? 
1 1 1   12   22   17 o 24.40030 2.095165   29.21781   272.0   6.044501 1.022453          ?        ? 
1 1 1   12   22   18 o 14.50663 3.463364   18.11368   263.3   2.315555 0.9923807          ?        ? 
1 1 1   12   22   19 o 6.453251 3.026862   3.111141     2.8 -0.9021643 0.9923807          ?        ? 
1 1 1   12   22   20 o 19.06911 2.917465   19.30167   323.8   3.909379 1.112669          ?        ? 
1 1 1   12   22   21 o 10.86495 4.041694   6.831266   138.6   1.323174 1.172814          ?        ? 
1 1 1   12   23    0 f 112.5453 1.804641   54.03002   180.0   126.8142 4.059740   126.8142 4.059740 
1 1 1   12   23    1 o 71.17224 1.140821   73.21879   264.4   50.67156 1.623896          ?        ? 
1 1 1   12   23    2 o 52.64632 1.199543   12.52989   354.5   27.72652 1.263030          ?        ? 
1 1 1   12   23    3 o 36.28439 1.284625   39.88144   342.4   13.17160 0.9322364          ?        ? 
1 1 1   12   23    4 o 145.2449 1.304380   169.6319    49.6   211.0764 3.789090          ?        ? 
1 1 1   12   23    5 o 171.4493 1.403197   173.2829   249.7   294.1357 4.811543          ?        ? 
1 1 1   12   23    6 o 157.2706 1.328929   154.8364   225.3   247.5238 4.180028          ?        ? 
1 1 1   12   23    7 o 195.0140 1.511209   216.2626   182.6   380.6532 5.894140          ?        ? 
1 1 1   12   23    8 o 63.22734 0.9988006   57.98939    19.1   39.99595 1.263030          ?        ? 
1 1 1   12   23    9 o 10.82197 3.698273   27.84598   349.9   1.082597 0.9623086          ?        ? 
1 1 1   12   23   10 o 88.08482 1.143690   80.96157   214.4   77.64628 2.014834          ?        ? 
1 1 1   12   23   11 o 40.85952 1.508777   30.45767    85.5   16.72011 1.232958          ?        ? 
1 1 1   12   23   12 f 56.95069 1.267292   71.59972   140.8   32.47792 1.443463          ?        ? 
1 1 1   12   23   13 o 78.35267 1.266556   75.03846   239.8   61.49754 1.984761          ?        ? 
1 1 1   12   23   14 o 66.10744 1.319204   61.01176   307.1   43.81511 1.744184          ?        ? 
1 1 1   12   23   15 o 32.13843 1.824628   45.04804   201.2   10.40496 1.172814          ?        ? 
1 1 1   12   23   16 o 34.20491 1.626476   42.68935   213.8   11.78828 1.112669          ?        ? 
1 1 1   12   23   17 o 26.71886 2.025904   33.31764    53.5   7.247387 1.082597          ?        ? 
1 1 1   12   23   18 o 43.21357 1.461381   44.90698   321.0   18.88531 1.263030          ?        ? 
1 1 1   12   23   19 o 40.83929 1.583159   43.18032   300.7   16.96069 1.293102          ?        ? 
1 1 1   12   23   20 o 11.13186 3.960633   4.027706    23.8   1.353247 1.112669          ?        ? 
1 1 1   12   24    0 o 87.65937 1.647973   115.8269     0.0   76.95461 2.886926   76.95461 2.886926 
1 1 1   12   24    1 o 76.12801 1.165311   50.06472    59.9   57.97910 1.774257          ?        ? 
1 1 1   12   24    2 o 87.00204 1.071511   105.3418   197.7   75.72166 1.864473          ?        ? 
1 1 1   12   24    3 o 96.90536 1.132686   82.19868   312.3   93.94538 2.195267          ?        ? 
1 1 1   12   24    4 o 46.65173 1.063606   46.79531   264.1   21.77223 0.9923807          ?        ? 
1 1 1   12   24    5 o 21.29284 1.906622   21.02538   146.5   4.540894 0.8119479          ?        ? 
1 1 1   12   24    6 o 95.41845 1.071546   119.7830    90.4   91.08852 2.044906          ?        ? 
1 1 1   12   24    7 o 93.65133 1.027544   87.47880   263.6   87.75051 1.924617          ?        ? 
1 1 1   12   24    8 o 79.55931 1.001658   83.16782   280.4   63.33194 1.593824          ?        ? 
1 1 1   12   24    9 o 86.24588 1.046038   92.75881    85.4   74.42856 1.804329          ?        ? 
1 1 1   12   24   10 f 93.57233 1.124825   69.35542    43.9   87.63023 2.105050          ?        ? 
1 1 1   12   24   11 o 71.83717 1.234915   70.26875   303.0   51.66394 1.774257          ?        ? 
1 1 1   12   24   12 o 41.79378 1.439073   37.11619   248.7   17.50199 1.202886          ?        ? 
1 1 1   12   24   13 o 49.86403 1.477553   52.47144    62.4   24.92981 1.473535          ?        ? 
1 1 1   12   24   14 o 42.64053 1.586808   39.92695   338.7   18.25379 1.353247          ?        ? 
1 1 1   12   24   15 o 48.89962 1.445196   50.31130    36.3   24.02764 1.413391          ?        ? 
1 1 1   12   24   16 o 19.07209 2.838172   14.54634   342.8   3.728946 1.082597          ?        ? 
1 1 1   12   24   17 o 35.03551 1.630833   30.90806   186.3   12.41980 1.142741          ?        ? 
1 1 1   12   24   18 o 13.83800 3.478240   4.821523   132.0   2.135122 0.9623086          ?        ? 
1 1 1   12   24   19 o 27.74081 2.005474   26.95292   355.4   7.939046 1.112669          ?        ? 
1 1 1   12   24   20 o 8.537207 3.628167   3.032434    79.1  0.3307936 1.082597          ?        ? 
1 1 1   12   25    0 o 228.7059 2.821386   207.8800     0.0   523.9771 12.90095   523.9771 12.90095 
1 1 1   12   25    1 o 126.8845 1.374624   157.9915   330.6   161.0965 3.488369          ?        ? 
1 1 1   12   25    2 o 88.18460 1.074193   105.1881   188.3   77.79664 1.894545          ?        ? 
1 1 1   12   25    3 o 121.6630 1.198802   130.2248   243.7   148.1053 2.916998          ?        ? 
1 1 1   12   25    4 o 99.32157 1.089992   106.3317    52.6   98.69678 2.165194          ?        ? 
1 1 1   12   25    5 o 112.8369 1.106016   123.6039    27.0   127.3856 2.495988          ?        ? 
1 1 1   12   25    6 o 104.5079 1.093450   121.1912   225.6   109.2822 2.285483          ?        ? 
1 1 1   12   25    7 o 53.09476 1.076134   93.78168   314.4   28.20767 1.142741          ?        ? 
1 1 1   12   25    8 o 71.81432 1.025934   98.12061   355.9   51.60380 1.473535          ?        ? 
1 1 1   12   25    9 o 47.08969 1.181436   61.80607    76.2   22.19324 1.112669          ?        ? 
1 1 1   12   25   10 o 98.56390 1.067861   94.81512   238.7   97.22324 2.105050          ?        ? 
1 1 1   12   25   11 o 40.14988 1.423095   57.77621   142.6   16.14874 1.142741          ?        ? 
1 1 1   12   25   12 o 115.5833 1.326904   117.4873   269.5   133.8511 3.067359          ?        ? 
1 1 1   12   25   13 o 41.67721 1.695640   36.80764    73.8   17.44184 1.413391          ?        ? 
1 1 1   12   25   14 o 55.90893 1.425375   50.38008   296.6   31.39532 1.593824          ?        ? 
1 1 1   12   25   15 o 66.15901 1.272722   65.98993   185.7   43.96547 1.684040          ?        ? 
1 1 1   12   25   16 o 20.47972 2.643095   19.04351    56.2   4.300317 1.082597          ?        ? 
1 1 1   12   25   17 o 20.17947 2.831445   20.47432   280.1   4.240172 1.142741          ?        ? 
1 1 1   12   25   18 o 43.17113 1.462818   44.78564   254.6   18.88531 1.263030          ?        ? 
1 1 1   12   25   19 o 22.07034 2.656991   21.08187   119.8   5.172409 1.172814          ?        ? 
1 1 1   12   25   20 o 7.838700 3.492411   5.962745   334.7      -0.09 1.112669          ?        ? 
1 1 1   12   26    0 o 149.2963 2.247039   190.8409   180.0   223.2857 6.706088   223.2857 6.706088 
1 1 1   12   26    1 o 88.71738 1.237225   97.30634   174.5   78.75894 2.195267          ?        ? 
1 1 1   12   26    2 o 46.80873 1.156405   39.48005   317.1   21.92259 1.082597          ?        ? 
1 1 1   12   26    3 o 87.56928 0.9958884   100.2288   316.5   76.71404 1.744184          ?        ? 
1 1 1   12   26    4 o 25.76182 1.750972   24.66910     9.5   6.645944 0.9021643          ?        ? 
1 1 1   12   26    5 o 193.0967 1.541788   206.2354   200.8   373.2856 5.954284          ?        ? 
1 1 1   12   26    6 o 49.36894 1.096436   79.02164   231.0   24.38851 1.082597          ?        ? 
1 1 1   12   26    7 o 160.7829 1.393416   165.5541   238.8   258.8009 4.480750          ?        ? 
1 1 1   12   26    8 o 30.75319 1.662353   47.72970   322.5   9.472726 1.022453          ?        ? 
1 1 1   12   26    9 o 53.59467 1.150262   48.47068   281.8   28.74897 1.232958          ?        ? 
1 1 1   12   26   10 o 53.10655 1.245773   57.18593   339.1   28.23775 1.323174          ?        ? 
1 1 1   12   26   11 o 72.78809 1.136153   81.19009   132.5   53.04726 1.653968          ?        ? 
1 1 1   12   26   12 o 49.51876 1.275305   50.38913    72.7   24.56894 1.263030          ?        ? 
1 1 1   12   26   13 o 62.18243 1.450835   65.73598   272.0   38.79307 1.804329          ?        ? 
1 1 1   12   26   14 o 43.56836 1.622038   47.26920    54.5   19.09581 1.413391          ?        ? 
1 1 1   12   26   15 f 18.88395 3.105319   5.578045    18.1   3.668802 1.172814          ?        ? 
1 1 1   12   26   16 f 10.90695 4.160102   12.30697   351.6  0.9623086 1.263030          ?        ? 
1 1 1   12   26   17 o 14.21175 3.752810   25.08427   202.1   2.255411 1.082597          ?        ? 
1 1 1   12   26   18 o 11.07545 3.910140   19.56070    57.0   1.263030 1.082597          ?        ? 
1 1 1   12   26   19 o 15.86421 3.590136   9.140159   131.6   2.916998 1.112669          ?        ? 
1 1 1   12   27    0 o 188.3628 2.403611   192.4976   180.0   355.4227 9.051716   355.4227 9.051716 
1 1 1   12   27    1 o 67.67700 1.177522   62.60269    11.5   45.82995 1.593824          ?        ? 
1 1 1   12   27    2 o 191.5383 1.577883   206.5891   132.6   367.3012 6.044501          ?        ? 
1 1 1   12   27    3 o 66.98853 1.032504   80.26573   203.3   44.89771 1.383319          ?        ? 
1 1 1   12   27    4 o 55.12257 1.118379   56.87638   149.6   30.40294 1.232958          ?        ? 
1 1 1   12   27    5 o 29.55673 1.729645   35.72342   268.4   8.750995 1.022453          ?        ? 
1 1 1   12   27    6 o 7.461358 3.215879   10.06939   338.2      -0.09 0.8720922          ?        ? 
1 1 1   12   27    7 o 52.86434 1.137710   57.32989    68.9   27.96709 1.202886          ?        ? 
1 1 1   12   27    8 o 47.17878 1.306687   43.83610   265.0   22.28346 1.232958          ?        ? 
1 1 1   12   27    9 o 42.79845 1.405291   53.92566   178.8   18.34401 1.202886          ?        ? 
1 1 1   12   27   10 o 65.51468 1.124584   83.91916   204.3   42.97309 1.473535          ?        ? 
1 1 1   12   27   11 o 54.09991 1.222899   45.60289    10.3   29.32034 1.323174          ?        ? 
1 1 1   12   27   12 o 50.99931 1.267765   50.00198   227.0   26.07255 1.293102          ?        ? 
1 1 1   12   27   13 o 28.98563 2.074969   35.62019   135.9   8.480345 1.202886          ?        ? 
1 1 1   12   27   14 o 36.30948 1.739257   42.39827   210.9   13.29189 1.263030          ?        ? 
1 1 1   12   27   15 o 26.26582 2.633305   21.59549   129.1   7.066954 1.383319          ?        ? 
1 1 1   12   27   16 o 25.03234 2.522796   32.63631    89.1   6.465511 1.263030          ?        ? 
1 1 1   12   27   17 o 15.45140 3.400522   11.70803   129.0   2.646349 1.022453          ?        ? 
1 1 1   12   27   18 o 11.91711 3.922611   6.172724     8.5   1.593824 1.082597          ?        ? 
1 1 1   12   27   19 o 31.98597 1.927342   32.59075    47.5   10.67561 1.232958          ?        ? 
1 1 1   12   28    0 o 130.8126 1.931996   133.3326    -0.0   171.3812 5.052120   171.3812 5.052120 
1 1 1   12   28    1 o 93.40035 1.239586   94.92195    61.7   87.29943 2.315555          ?        ? 
1 1 1   12   28    2 o 39.60211 1.366843   43.75533   118.1   15.69766 1.082597          ?        ? 
1 1 1   12   28    3 o 70.50474 1.044990   72.79232   159.8   49.73933 1.473535          ?        ? 
1 1 1   12   28    4 o 151.3177 1.321589   139.9657   358.0   229.2099 3.999595          ?        ? 
1 1 1   12   28    5 o 92.69208 1.103064   96.44779   198.8   85.97626 2.044906          ?        ? 
1 1 1   12   28    6 o 54.76392 1.098247   57.74253   196.8   30.01200 1.202886          ?        ? 
1 1 1   12   28    7 o 82.64397 1.091628   71.49471    18.5   68.35399 1.804329          ?        ? 
1 1 1   12   28    8 o 20.25094 2.524459   19.77306   139.9   4.119884 1.022453          ?        ? 
1 1 1   12   28    9 o 23.60048 2.166170   10.67635   138.5   5.593419 1.022453          ?        ? 
1 1 1   12   28   10 o 28.75325 1.934858   27.94480   276.7   8.299912 1.112669          ?        ? 
1 1 1   12   28   11 o 60.66793 1.164858   63.92392    66.9   36.86845 1.413391          ?        ? 
1 1 1   12   28   12 o 101.3945 1.201172   85.90829    30.4   103.0572 2.435844          ?        ? 
1 1 1   12   28   13 o 39.65604 1.592481   41.61949    23.3   15.81795 1.263030          ?        ? 
1 1 1   12   28   14 o 24.37627 2.405646   26.87497   254.8   6.044501 1.172814          ?        ? 
1 1 1   12   28   15 o 42.93470 1.470873   38.79715   338.9   18.58459 1.263030          ?        ? 
1 1 1   12   28   16 o 32.28688 1.862809   27.51554   251.7   10.61547 1.202886          ?        ? 
1 1 1   12   28   17 o 24.82604 2.301498   29.57958   163.1   6.375295 1.142741          ?        ? 
1 1 1   12   28   18 o 35.12804 1.926163   38.35201   231.5   12.75059 1.353247          ?        ? 
1 1 1   12   28   19 o 28.67349 2.202435   22.16175   337.1   8.720922 1.263030          ?        ? 
1 1 1   12   29    0 o 24.24386 3.822012   54.06513    -0.0   6.224934 1.744184   6.224934 1.744184 
1 1 1   12   29    1 o 205.9491 1.598890   194.6533   121.2   424.7991 6.585800          ?        ? 
1 1 1   12   29    2 o 147.6404 1.334137   151.6315   354.4   218.2035 3.939451          ?        ? 
1 1 1   12   29    3 o 106.3243 1.145478   122.4329   342.8   113.1314 2.435844          ?        ? 
1 1 1   12   29    4 o 184.0676 1.519393   189.7344   157.5   339.2439 5.593419          ?        ? 
1 1 1   12   29    5 o 110.7635 1.140295   123.1608   124.2   122.7846 2.526060          ?        ? 
1 1 1   12   29    6 o 62.13560 1.161543   47.84031     5.1   38.64271 1.443463          ?        ? 
1 1 1   12   29    7 o 49.14317 1.254455   33.50090   182.8   24.17801 1.232958          ?        ? 
1 1 1   12   29    8 o 59.27938 1.192144   41.90402   161.4   35.18441 1.413391          ?        ? 
1 1 1   12   29    9 o 71.09763 1.120870   54.59579   229.4   50.61142 1.593824          ?        ? 
1 1 1   12   29   10 o 53.98841 1.225425   56.43631   333.4   29.20005 1.323174          ?        ? 
1 1 1   12   29   11 o 78.36539 1.112854   74.94660   301.5   61.52761 1.744184          ?        ? 
1 1 1   12   29   12 o 49.68111 1.331668   50.76130   213.6   24.77945 1.323174          ?        ? 
1 1 1   12   29   13 o 46.54987 1.485846   47.86648   304.9   21.80231 1.383319          ?        ? 
1 1 1   12   29   14 o 13.83975 4.007365   26.00575   241.6   2.074978 1.172814          ?        ? 
1 1 1   12   29   15 o 21.40502 2.739576   24.48165    33.7   4.751399 1.172814          ?        ? 
1 1 1   12   29   16 o 21.29612 2.753585   17.17406   170.9   4.751399 1.172814          ?        ? 
1 1 1   12   29   17 o 25.65136 2.461917   21.40805   220.3   6.886521 1.263030          ?        ? 
1 1 1   12   29   18 o 10.98589 3.857767   13.22407   297.5   1.353247 1.052525          ?        ? 
1 1 1   12   30    0 o 228.3163 2.707549   224.6578     0.0   522.5637 12.35965   522.5637 12.35965 
1 1 1   12   30    1 o 178.6816 1.489456   170.3799   328.8   319.6669 5.322770          ?        ? 
1 1 1   12   30    2 o 74.07494 1.136714   82.61790    86.2   54.91174 1.684040          ?        ? 
1 1 1   12   30    3 o 89.35575 1.076941   56.78066    73.9   79.90170 1.924617          ?        ? 
1 1 1   12   30    4 o 32.73433 1.699545   33.86811   196.5   10.73576 1.112669          ?        ? 
1 1 1   12   30    5 o 135.2159 1.234325   125.8094   248.1   183.0191 3.338008          ?        ? 
1 1 1   12   30    6 o 18.69899 2.894801   16.69664   165.8   3.518441 1.082597          ?        ? 
1 1 1   12   30    7 o 66.46941 1.176294   57.48551   195.9   44.23613 1.563751          ?        ? 
1 1 1   12   30    8 o 50.27325 1.375800   44.69638   215.4   25.32075 1.383319          ?        ? 
1 1 1   12   30    9 o 60.42501 1.119774   56.67690   215.9   36.56773 1.353247          ?        ? 
1 1 1   12   30   10 o 105.3325 1.156264   103.1262   204.8   111.1767 2.435844          ?        ? 
1 1 1   12   30   11 o 23.06853 2.346481   30.89938   206.4   5.382914 1.082597          ?        ? 
1 1 1   12   30   12 o 57.96823 1.141293   64.15973   211.2   33.71087 1.323174          ?        ? 
1 1 1   12   30   13 f 41.26723 1.639614   40.77771   207.9   17.17119 1.353247          ?        ? 
1 1 1   12   30   14 o 31.01522 2.036146   33.82459   239.4   9.773447 1.263030          ?        ? 
1 1 1   12   30   15 o 29.24141 2.108239   38.06211   267.8   8.750995 1.232958          ?        ? 
1 1 1   12   30   16 o 15.27919 3.839502   18.18200   148.9   2.646349 1.172814          ?        ? 
1 1 1   12   30   17 o 7.538174 3.446184  0.5300103   169.0 -0.5412986 1.172814          ?        ? 
1 1 1   12   30   18 o 19.06478 2.996997   22.17137   288.6   4.029667 1.142741          ?        ? 
1 1 1   12   31    0 f 180.5143 2.208079   127.1226   180.0   326.5234 7.969118   326.5234 7.969118 
1 1 1   12   31    1 o 124.2870 1.246080   114.4421   142.2   154.6310 3.097431          ?        ? 
1 1 1   12   31    2 f 75.47957 1.095639   75.19276   316.8   57.01679 1.653968          ?        ? 
1 1 1   12   31    3 o 106.6791 1.198047   89.13837   323.5   113.9133 2.556132          ?        ? 
1 1 1   12   31    4 o 180.1340 1.435711   172.3351    54.0   324.9596 5.172409          ?        ? 
1 1 1   12   31    5 o 89.12334 1.130363   91.50365   342.6   79.51075 2.014834          ?        ? 
1 1 1   12   31    6 o 27.25950 1.985724   37.05582   263.5   7.457891 1.082597          ?        ? 
1 1 1   12   31    7 o 32.44196 1.714861   3.773222   105.8   10.55532 1.112669          ?        ? 
1 1 1   12   31    8 f 84.12289 1.143932   69.80377   101.5   70.88004 1.924617          ?        ? 
1 1 1   12   31    9 o 31.81368 1.701465   23.67654   154.9   10.16438 1.082597          ?        ? 
1 1 1   12   31   10 o 25.14274 2.152902   35.59492    27.8   6.375295 1.082597          ?        ? 
1 1 1   12   31   11 o 34.25727 1.755665   39.09164   262.0   11.81835 1.202886          ?        ? 
1 1 1   12   31   12 o 35.27131 1.662560   23.52344   150.2   12.54008 1.172814          ?        ? 
1 1 1   12   31   13 o 37.93738 1.585357   38.64342   125.1   14.52485 1.202886          ?        ? 
1 1 1   12   31   14 o 47.01228 1.471231   48.46251   196.8   22.34361 1.383319          ?        ? 
1 1 1   12   31   15 o 7.449651 3.422582   7.164422    58.1 -0.6916593 1.172814          ?        ? 
1 1 1   12   31   16 o 38.94979 1.737168   36.50553     0.0   15.51723 1.353247          ?        ? 
1 1 1   12   31   17 f 34.09093 1.984760   37.33189    65.5   12.08900 1.353247          ?        ? 
1 1 1   12   32    0 o 88.28054 1.824175   102.3275   180.0   78.12743 3.217719   78.12743 3.217719 
1 1 1   12   32    1 o 97.36131 1.111938   88.22247   218.9   94.87762 2.165194          ?        ? 
1 1 1   12   32    2 o 99.38863 1.134642   129.9791   240.8   98.87720 2.255411          ?        ? 
1 1 1   12   32    3 o 48.64479 1.329127   45.98299   266.2   23.69685 1.293102          ?        ? 
1 1 1   12   32    4 o 120.7930 1.182541   90.09659   238.6   146.0905 2.856854          ?        ? 
1 1 1   12   32    5 o 45.64376 1.350631   36.98867    52.5   20.87007 1.232958          ?        ? 
1 1 1   12   32    6 f 61.61106 1.147027   43.88239   237.1   38.01119 1.413391          ?        ? 
1 1 1   12   32    7 f 88.94550 1.149528   88.13324   357.1   79.24010 2.044906          ?        ? 
1 1 1   12   32    8 f 29.03860 1.967625   21.16292    19.4   8.480345 1.142741          ?        ? 
1 1 1   12   32    9 o 57.09587 1.264070   53.30783   299.9   32.68842 1.443463          ?        ? 
1 1 1   12   32   10 o 31.91433 1.743213   49.12847    27.4   10.25460 1.112669          ?        ? 
1 1 1   12   32   11 o 100.4174 1.123018   99.88157    50.6   101.1928 2.255411          ?        ? 
1 1 1   12   32   12 f 51.57671 1.341030   67.10326    32.9   26.76421 1.383319          ?        ? 
1 1 1   12   32   13 o 19.38915 2.714211   8.267909   342.3   3.879307 1.052525          ?        ? 
1 1 1   12   32   14 o 60.50835 1.366727   58.78433     3.7   36.98874 1.653968          ?        ? 
1 1 1   12   32   15 o 15.90029 3.977720   19.65467   270.9   2.886926 1.263030          ?        ? 
1 1 1   12   32   16 f 7.469309 3.461792   3.714718     9.3 -0.7518036 1.232958          ?        ? 
1 1 1   12   32   17 o 17.85778 3.578405   24.67993    58.5   3.759018 1.232958          ?        ? 
1 1 1   12   33    0 o 97.53844 1.743199   83.57798   180.0   95.35877 3.398152   95.35877 3.398152 
1 1 1   12   33    1 o 69.69278 1.121889   68.99212   303.6   48.62666 1.563751          ?        ? 
1 1 1   12   33    2 o 48.17299 1.342144   38.23326   141.0   23.24577 1.293102          ?        ? 
1 1 1   12   33    3 o 127.4105 1.227333   141.6025   116.2   162.5700 3.127503          ?        ? 
1 1 1   12   33    4 o 38.83899 1.664696   40.04175   255.6   15.12629 1.293102          ?        ? 
1 1 1   12   33    5 o 108.6728 1.120724   95.10972   211.9   118.2737 2.435844          ?        ? 
1 1 1   12   33    6 o 14.63111 3.925556   21.09661    16.0   2.255411 1.172814          ?        ? 
1 1 1   12   33    7 o 37.12257 1.579650   48.69555    38.5   13.83319 1.172814          ?        ? 
1 1 1   12   33    8 o 62.32666 1.206231   64.98206   108.9   38.94343 1.503607          ?        ? 
1 1 1   12   33    9 o 62.01326 1.212327   64.55762    20.2   38.58256 1.503607          ?        ? 
1 1 1   12   33   10 f 75.23392 1.159174   62.79387   336.8   56.80628 1.744184          ?        ? 
1 1 1   12   33   11 o 59.23957 1.167563   49.54707   331.1   35.24455 1.383319          ?        ? 
1 1 1   12   33   12 o 19.88761 2.646183   29.65735    27.7   4.059740 1.052525          ?        ? 
1 1 1   12   33   13 o 16.13396 3.455117   13.52991   208.6   2.856854 1.082597          ?        ? 
1 1 1   12   33   14 o 32.10570 1.966987   30.58867    29.1   10.55532 1.263030          ?        ? 
1 1 1   12   33   15 o 40.27769 1.717227   37.68044   293.0   16.59982 1.383319          ?        ? 
1 1 1   12   33   16 o 22.47102 2.944180   24.27571   359.7   5.503202 1.323174          ?        ? 
1 1 1   12   34    0 o 8.142249 5.185675   19.45510     0.0  0.3007214 1.804329  0.3007214 1.804329 
1 1 1   12   34    1 o 37.22066 1.656282   58.37737   336.8   13.89333 1.232958          ?        ? 
1 1 1   12   34    2 o 19.68505 2.826180   23.72709   338.4   3.909379 1.112669          ?        ? 
1 1 1   12   34    3 o 29.56227 1.983633   33.17948   326.5   8.781067 1.172814          ?        ? 
1 1 1   12   34    4 o 139.4337 1.240122   123.0188   116.9   194.7773 3.458297          ?        ? 
1 1 1   12   34    5 o 58.57135 1.206555   58.73916   200.2   34.37246 1.413391          ?        ? 
1 1 1   12   34    6 o 87.26577 1.206115   83.98080   106.0   76.32310 2.105050          ?        ? 
1 1 1   12   34    7 o 57.40344 1.257297   64.61430   142.1   33.04929 1.443463          ?        ? 
1 1 1   12   34    8 o 37.24598 1.614786   32.91471   243.8   13.95348 1.202886          ?        ? 
1 1 1   12   34    9 o 90.69435 1.160519   82.02727   197.9   82.54803 2.105050          ?        ? 
1 1 1   12   34   10 o 76.48798 1.199143   85.71659   174.6   58.76097 1.834401          ?        ? 
1 1 1   12   34   11 o 12.46308 4.028425   11.26294   212.6   1.623896 1.142741          ?        ? 
1 1 1   12   34   12 o 13.22530 3.989496   12.46882    79.9   1.924617 1.142741          ?        ? 
1 1 1   12   34   13 o 13.29631 3.985194   22.84935   186.0   1.984761 1.142741          ?        ? 
1 1 1   12   34   14 o 40.67325 1.700526   35.37750   188.8   16.87047 1.383319          ?        ? 
1 1 1   12   34   15 o 13.55391 4.032211   13.97507   164.9   2.165194 1.172814          ?        ? 
1 1 1   12   34   16 o 8.893699 3.875413   7.398594   100.0  0.2405772 1.293102          ?        ? 
1 1 1   12   35    0 o 69.59402 1.947859   91.45940   180.0   48.65673 2.706493   48.65673 2.706493 
1 1 1   12   35    1 o 40.27538 1.567993   53.53111    55.9   16.26903 1.263030          ?        ? 
1 1 1   12   35    2 o 100.9777 1.221020   87.94244   142.0   102.1551 2.465916          ?        ? 
1 1 1   12   35    3 o 56.55110 1.302835   49.68631     8.0   32.05691 1.473535          ?        ? 
1 1 1   12   35    4 o 31.13376 1.835213   32.14847    37.2   9.743376 1.142741          ?        ? 
1 1 1   12   35    5 o 36.50245 1.647678   32.13496    56.0   13.38210 1.202886          ?        ? 
1 1 1   12   35    6 o 52.39105 1.291486   49.06711    53.0   27.54608 1.353247          ?        ? 
1 1 1   12   35    7 o 12.12042 3.976719   16.16698    60.9   1.473535 1.112669          ?        ? 
1 1 1   12   35    8 o 45.76901 1.346935   48.80566   140.5   21.05050 1.232958          ?        ? 
1 1 1   12   35    9 o 42.68848 1.479357   28.67185    18.2   18.34401 1.263030          ?        ? 
1 1 1   12   35   10 o 38.83778 1.548603   36.95332   205.0   15.21651 1.202886          ?        ? 
1 1 1   12   35   11 o 33.45695 1.797662   30.38494   318.1   11.36727 1.202886          ?        ? 
1 1 1   12   35   12 o 34.83656 1.812794   37.18902   128.7   12.35965 1.263030          ?        ? 
1 1 1   12   35   13 o 7.346202 3.357687   12.45237   323.6 -0.6014429 1.112669          ?        ? 
1 1 1   12   35   14 o 18.60814 3.847597   16.60570    23.3   3.999595 1.383319          ?        ? 
1 1 1   12   35   15 o 29.70365 2.176673   21.15153    85.2   9.292293 1.293102          ?        ? 
1 1 1   12   36    0 o 128.3280 2.098582   99.94559    -0.0   165.3667 5.382914   165.3667 5.382914 
1 1 1   12   36    1 o 15.32972 3.831843   24.12193    54.3   2.495988 1.172814          ?        ? 
1 1 1   12   36    2 o 86.39016 1.166124   85.71156   184.4   74.78942 2.014834          ?        ? 
1 1 1   12   36    3 o 34.76187 1.773434   24.14298   111.5   12.14915 1.232958          ?        ? 
1 1 1   12   36    4 o 61.27990 1.275909   64.26461   144.1   37.68040 1.563751          ?        ? 
1 1 1   12   36    5 o 6.940030 3.226985   8.748022   231.2 -0.9322364 1.082597          ?        ? 
1 1 1   12   36    6 o 57.79435 1.274809   56.28830     9.0   33.53044 1.473535          ?        ? 
1 1 1   12   36    7 o 36.90712 1.548131   29.72739    54.1   13.71290 1.142741          ?        ? 
1 1 1   12   36    8 o 25.10878 2.275582   35.22873   175.0   6.405366 1.142741          ?        ? 
1 1 1   12   36    9 o 27.14439 2.104931   19.69192   190.8   7.487964 1.142741          ?        ? 
1 1 1   12   36   10 o 27.62173 2.122991   24.45181   239.8   7.788685 1.172814          ?        ? 
1 1 1   12   36   11 f 29.27290 2.157337   19.66269    50.7   8.781067 1.263030          ?        ? 
1 1 1   12   36   12 o 24.65750 2.500168   20.90040    60.3   6.315150 1.232958          ?        ? 
1 1 1   12   36   13 f 9.970249 3.879837   19.58127   347.5  0.8420200 1.112669          ?        ? 
1 1 1   12   36   14 o 7.383671 3.481023   9.901223   158.0  -1.142741 1.353247          ?        ? 
1 1 1   12   36   15 o 8.590504 3.858849   8.478457   103.1      -0.09 1.383319          ?        ? 
1 1 1   12   37    0 o 47.48386 2.259191   52.71695   360.0   22.82476 2.135122   22.82476 2.135122 
1 1 1   12   37    1 f 94.47320 1.177762   88.54552   126.9   89.52478 2.225339          ?        ? 
1 1 1   12   37    2 o 31.51113 1.956385   29.89978   145.7   10.01402 1.232958          ?        ? 
1 1 1   12   37    3 o 94.09567 1.150528   87.78316    18.7   88.80304 2.165194          ?        ? 
1 1 1   12   37    4 o 78.32408 1.209427   88.05213   181.2   61.55768 1.894545          ?        ? 
1 1 1   12   37    5 o 17.33200 3.328624   13.03242   318.1   3.187647 1.112669          ?        ? 
1 1 1   12   37    6 o 33.34273 1.758725   29.48510   316.6   11.21691 1.172814          ?        ? 
1 1 1   12   37    7 o 40.87874 1.544850   38.44792   149.7   16.84040 1.263030          ?        ? 
1 1 1   12   37    8 o 23.57318 2.487602   19.41654    16.1   5.683635 1.172814          ?        ? 
1 1 1   12   37    9 o 14.61793 4.069600   19.67885    27.7   2.375700 1.232958          ?        ? 
1 1 1   12   37   10 o 28.05225 2.144010   24.83690   314.0   8.059335 1.202886          ?        ? 
1 1 1   12   37   11 o 8.860804 3.744816   3.790079    17.9  0.2405772 1.142741          ?        ? 
1 1 1   12   37   12 o 25.36231 2.430690   26.53252   144.9   6.706088 1.232958          ?        ? 
1 1 1   12   37   13 o 6.740205 3.184311   7.960131    52.2  -1.082597 1.142741          ?        ? 
1 1 1   12   37   14 o 9.993898 4.166165   14.17745   250.2  0.7518036 1.383319          ?        ? 
1 1 1   12   38    0 o 25.06330 3.139929   30.07901   180.0   6.645944 1.533679   6.645944 1.533679 
1 1 1   12   38    1 o 24.82787 2.422451   30.25397   275.5   6.255006 1.202886          ?        ? 
1 1 1   12   38    2 o 50.64209 1.365780   46.98306   313.1   25.77183 1.383319          ?        ? 
1 1 1   12   38    3 o 13.28408 4.048558   18.81533   101.3   1.864473 1.172814          ?        ? 
1 1 1   12   38    4 o 79.74946 1.150102   69.51521    90.6   63.84316 1.834401          ?        ? 
1 1 1   12   38    5 o 22.13253 2.853334   17.55898   307.0   5.022048 1.263030          ?        ? 
1 1 1   12   38    6 o 62.15860 1.257872   51.29411   114.5   38.85321 1.563751          ?        ? 
1 1 1   12   38    7 f 41.28501 1.566067   41.35785    63.5   17.20127 1.293102          ?        ? 
1 1 1   12   38    8 o 12.40516 4.134791   12.99772   165.7   1.623896 1.202886          ?        ? 
1 1 1   12   38    9 o 13.38733 3.979676   9.210491   349.1   1.984761 1.142741          ?        ? 
1 1 1   12   38   10 o 15.07164 3.711055   12.41220   353.8   2.556132 1.112669          ?        ? 
1 1 1   12   38   11 o 16.85143 3.755506   9.815183    40.4   3.217719 1.232958          ?        ? 
1 1 1   12   38   12 o 23.39251 2.506815   20.48420   185.7   5.773852 1.172814          ?        ? 
1 1 1   12   38   13 f 11.28822 4.107861   15.01416   240.8   1.443463 1.202886          ?        ? 
1 1 1   12   39    0 o 11.65270 5.510767   8.865917     0.0   2.074978 1.443463   2.074978 1.443463 
1 1 1   12   39    1 o 49.48323 1.397765   44.69728    97.2   24.62909 1.383319          ?        ? 
1 1 1   12   39    2 o 62.35019 1.254007   59.32495    36.1   39.06371 1.563751          ?        ? 
1 1 1   12   39    3 o 40.41858 1.636840   33.14215    25.6   16.47953 1.323174          ?        ? 
1 1 1   12   39    4 o 7.574121 3.407434   4.343586    67.7 -0.4510822 1.082597          ?        ? 
1 1 1   12   39    5 o 10.51121 3.931401   9.542082   130.5  0.9322364 1.112669          ?        ? 
1 1 1   12   39    6 o 15.68869 3.777449   12.52070   256.9   2.706493 1.172814          ?        ? 
1 1 1   12   39    7 o 9.958405 3.918625   18.87782   154.4  0.7217315 1.142741          ?        ? 
1 1 1   12   39    8 o 12.46696 4.028300   18.75636   262.2   1.684040 1.142741          ?        ? 
1 1 1   12   39    9 f 9.251230 3.845031   7.508865    42.7  0.3909379 1.172814          ?        ? 
1 1 1   12   39   10 o 19.33202 3.188900   20.55838    84.0   3.999595 1.232958          ?        ? 
1 1 1   12   39   11 o 16.22602 3.695467   6.039814    16.7   3.037287 1.172814          ?        ? 
1 1 1   12   39   12 o 33.48959 1.930603   27.03406   252.3   11.66799 1.293102          ?        ? 
1 1 1   12   39   13 o 31.11864 2.029379   31.57208   204.7   10.19446 1.263030          ?        ? 
1 1 1   12   40    0 o 43.50861 1.873672   43.86098     0.0   19.15596 1.623896   19.15596 1.623896 
1 1 1   12   40    1 o 23.92579 2.576630   14.53511   176.3   5.864068 1.232958          ?        ? 
1 1 1   12   40    2 o 24.98346 2.407364   13.19277   239.9   6.375295 1.202886          ?        ? 
1 1 1   12   40    3 o 38.30679 1.648572   34.89863   211.3   14.82557 1.263030          ?        ? 
1 1 1   12   40    4 o 34.86776 1.811172   42.62898   323.7   12.32958 1.263030          ?        ? 
1 1 1   12   40    5 o 30.28767 2.134701   19.96233   131.8   9.382509 1.293102          ?        ? 
1 1 1   12   40    6 o 9.829576 3.935956   11.45189   276.8  0.6315150 1.172814          ?        ? 
1 1 1   12   40    7 o 9.447581 3.877089   2.967671   210.8  0.4811543 1.172814          ?        ? 
1 1 1   12   40    8 o 45.25872 1.528234   38.60056   314.6   20.77985 1.383319          ?        ? 
1 1 1   12   40    9 o 25.84297 2.385480   26.30122   112.7   6.946666 1.232958          ?        ? 
1 1 1   12   40   10 o 20.37724 2.877755   17.92389     6.1   4.450677 1.172814          ?        ? 
1 1 1   12   40   11 o 32.29247 2.048735   31.86944   202.2   10.88612 1.323174          ?        ? 
1 1 1   12   40   12 o 21.25501 2.900394   17.32184   134.5   4.991976 1.232958          ?        ? 
1 1 1   12   41    0 o 47.96186 1.792409   46.61934   180.0   23.27584 1.714112   23.27584 1.714112 
1 1 1   12   41    1 f 50.95105 1.357498   51.02930   300.6   26.19284 1.383319          ?        ? 
1 1 1   12   41    2 o 11.65536 4.120964   13.45281   120.0   1.353247 1.202886          ?        ? 
1 1 1   12   41    3 o 7.545399 3.448111   11.24361   229.7 -0.6615872 1.172814          ?        ? 
1 1 1   12   41    4 o 30.91137 2.091629   32.34446   339.0   9.773447 1.293102          ?        ? 
1 1 1   12   41    5 o 38.05484 1.738510   34.78274    85.3   14.73535 1.323174          ?        ? 
1 1 1   12   41    6 o 49.64882 1.483958   46.73730   131.3   24.98995 1.473535          ?        ? 
1 1 1   12   41    7 o 12.36236 4.186164   11.89687   151.6   1.653968 1.232958          ?        ? 
1 1 1   12   41    8 o 9.045664 3.806918   8.062998   108.6  0.3307936 1.172814          ?        ? 
1 1 1   12   41    9 o 14.07157 4.119956   14.26746    45.0   2.345627 1.232958          ?        ? 
1 1 1   12   41   10 f 15.93519 4.121796   6.374320   354.2   3.097431 1.323174          ?        ? 
1 1 1   12   41   11 o 42.88129 1.648028   41.84153   105.1   19.00560 1.413391          ?        ? 
1 1 1   12   42    0 o 19.18069 4.614254   23.21447   180.0   4.420605 1.533679   4.420605 1.533679 
1 1 1   12   42    1 o 26.91588 2.290392   21.53276   178.5   7.457891 1.232958          ?        ? 
1 1 1   12   42    2 o 10.18319 4.016192   12.16474   202.9  0.7818757 1.202886          ?        ? 
1 1 1   12   42    3 o 11.90898 4.082658   17.84085   115.4   1.503607 1.172814          ?        ? 
1 1 1   12   42    4 f 22.45995 2.811738   26.01946   238.4   5.292697 1.263030          ?        ? 
1 1 1   12   42    5 o 25.36990 2.429962   29.09178   334.1   6.676016 1.232958          ?        ? 
1 1 1   12   42    6 o 6.331377 3.058872   2.755564     2.8  -1.653968 1.172814          ?        ? 
1 1 1   12   42    7 f 8.106471 3.620923   12.13250   241.0 -0.2405772 1.202886          ?        ? 
1 1 1   12   42    8 o 15.56057 3.952708   5.526022    53.9   2.856854 1.232958          ?        ? 
1 1 1   12   42    9 o 13.81920 4.318374   19.98489   335.1   2.375700 1.323174          ?        ? 
1 1 1   12   42   10 f 9.667969 4.029013   13.52258    39.0  0.6916593 1.293102          ?        ? 
1 1 1   12   43    0 o 9.592664 5.346347   4.045435   180.0   1.443463 1.503607   1.443463 1.503607 
1 1 1   12   43    1 o 34.39101 1.880000   26.22400   143.2   12.08900 1.293102          ?        ? 
1 1 1   12   43    2 o 78.99604 1.256241   75.05236   220.5   63.03122 1.984761          ?        ? 
1 1 1   12   43    3 o 12.33708 4.186164   16.17160   251.3   1.653968 1.232958          ?        ? 
1 1 1   12   43    4 o 7.788967 3.551251   6.901072   162.6 -0.5713707 1.232958          ?        ? 
1 1 1   12   43    5 o 12.59054 4.134796   14.24196    21.9   1.804329 1.202886          ?        ? 
1 1 1   12   43    6 o 16.97149 4.039581   10.85647    31.1   3.398152 1.353247          ?        ? 
1 1 1   12   43    7 o 14.77946 4.051883   14.91381   309.4   2.616277 1.232958          ?        ? 
1 1 1   12   43    8 o 11.85091 4.264365   6.000917    88.9   1.653968 1.293102          ?        ? 
1 1 1   12   43    9 o 16.82508 3.759628   10.30792   240.5   3.428224 1.232958          ?        ? 
1 1 1   12   44    0 o 62.72139 1.608522   46.96522     0.0   39.81552 2.014834   39.81552 2.014834 
1 1 1   12   44    1 o 27.52547 2.348920   14.04191    43.1   7.908974 1.293102          ?        ? 
1 1 1   12   44    2 o 10.46570 4.041988   8.030262   235.5  0.9923807 1.202886          ?        ? 
1 1 1   12   44    3 o 16.31853 3.837854   22.03853   270.3   3.097431 1.232958          ?        ? 
1 1 1   12   44    4 o 22.19363 2.777730   10.04856     1.4   5.262625 1.232958          ?        ? 
1 1 1   12   44    5 o 30.09791 2.198117   28.95412    78.1   9.472726 1.323174          ?        ? 
1 1 1   12   44    6 o 35.71774 1.936459   29.20939   227.6   13.29189 1.383319          ?        ? 
1 1 1   12   44    7 o 32.22877 2.052785   29.08473   303.0   10.91619 1.323174          ?        ? 
1 1 1   12   45    0 o 24.07307 3.215878   19.49714     0.0   6.194862 1.533679   6.194862 1.533679 
1 1 1   12   45    1 o 35.87688 1.927869   28.81787    81.8   13.32196 1.383319          ?        ? 
1 1 1   12   45    2 o 50.44100 1.430843   44.95350    30.9   25.95226 1.443463          ?        ? 
1 1 1   12   45    3 o 8.623673 3.793202   2.982823   265.7       0.06 1.263030          ?        ? 
1 1 1   12   45    4 o 15.94672 4.046279   8.190701   101.7   3.127503 1.293102          ?        ? 
1 1 1   12   45    5 o 10.67023 4.098494   8.254843   159.9   1.202886 1.232958          ?        ? 
1 1 1   12   45    6 o 21.80552 2.965080   17.66570   232.0   5.292697 1.293102          ?        ? 
1 1 1   12   46    0 o 9.774581 5.481434   5.098214   360.0   1.684040 1.593824   1.684040 1.593824 
1 1 1   12   46    1 o 11.78518 4.171623   9.240817   245.8   1.653968 1.232958          ?        ? 
1 1 1   12   46    2 o 10.36329 4.106454   6.007756   232.2   1.052525 1.263030          ?        ? 
1 1 1   12   46    3 o 8.861055 3.821519   9.001076   157.6  0.3307936 1.232958          ?        ? 
1 1 1   12   46    4 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   13    0    1 o 145.4759 1.499046   125.1805    90.0   211.7079 4.360461   211.7079 4.360461 
1 1 1   13    0    2 o 551.3040 4.560856   696.3877    90.0   3041.076 50.28062   3041.076 50.28062 
1 1 1   13    0    3 o 126.2584 1.357975   198.3340    90.0   159.4726 3.428224   159.4726 3.428224 
1 1 1   13    0    4 o 465.7902 3.800017   379.5930    90.0   2170.698 35.39491   2170.698 35.39491 
1 1 1   13    0    5 o 248.9496 2.180746   290.2492    90.0   619.9673 10.85604   619.9673 10.85604 
1 1 1   13    0    6 o 574.0736 4.623542   649.9059    90.0   3298.133 53.07734   3298.133 53.07734 
1 1 1   13    0    7 o 193.1336 2.118179   304.0781    90.0   373.1953 8.179624   373.1953 8.179624 
1 1 1   13    0    8 o 310.2957 3.058319   434.4391   270.0   963.5416 18.97552   963.5416 18.97552 
1 1 1   13    0    9 o 31.25622 1.449860   2.856403    90.0   9.833591 0.9021643   9.833591 0.9021643 
1 1 1   13    0   10 o 282.9139 2.833382   372.3661   270.0   801.2122 16.02845   801.2122 16.02845 
1 1 1   13    0   11 o 101.5902 1.214047   74.66630    90.0   103.2677 2.465916   103.2677 2.465916 
1 1 1   13    0   12 o 126.4102 1.332535   113.2903    90.0   159.8936 3.368080   159.8936 3.368080 
1 1 1   13    0   13 o 5.315588 3.310398   28.05186    90.0  0.2105050 0.6916593  0.2105050 0.6916593 
1 1 1   13    0   14 o 155.7061 1.758023   170.0902   270.0   242.7123 5.473131   242.7123 5.473131 
1 1 1   13    0   15 o 19.19237 2.328880   41.22596    90.0   3.849235 0.8720922   3.849235 0.8720922 
1 1 1   13    0   16 o 15.29909 3.625407   1.867357   270.0   2.706493 0.9623086   2.706493 0.9623086 
1 1 1   13    0   17 o 47.66082 1.390728   51.18954   270.0   22.79469 1.323174   22.79469 1.323174 
1 1 1   13    0   18 o 29.12942 2.567186   51.50897    90.0   8.720922 1.473535   8.720922 1.473535 
1 1 1   13    0   19 o 8.017626 5.143989   2.923007   270.0  0.2706493 1.804329  0.2706493 1.804329 
1 1 1   13    0   20 o 18.47058 5.001066   11.71086   270.0   4.180028 1.593824   4.180028 1.593824 
1 1 1   13    0   21 o 5.561048 3.934718  0.4214353   270.0  -1.563751 1.653968  -1.563751 1.653968 
1 1 1   13    0   22 o 31.14578 2.493330   34.82176    90.0   10.07417 1.533679   10.07417 1.533679 
1 1 1   13    0   23 o 26.83716 4.719396   22.52379    90.0   8.420200 2.315555   8.420200 2.315555 
1 1 1   13    1    0 o 31.30459 1.059352   9.981605   360.0   9.833591 0.6615872   9.833591 0.6615872 
1 1 1   13    1    1 o 116.2757 0.9181290   156.5800   335.9   135.2044 2.135122          ?        ? 
1 1 1   13    1    2 o 298.1274 1.830793   379.5007   284.5   888.9025 10.91619          ?        ? 
1 1 1   13    1    3 o 202.8794 1.334040   261.9914    90.6   411.6275 5.412986          ?        ? 
1 1 1   13    1    4 o 377.2235 2.264039   485.3314   239.3   1423.285 17.08098          ?        ? 
1 1 1   13    1    5 o 253.4246 1.566353   377.8327   233.2   642.3109 7.939046          ?        ? 
1 1 1   13    1    6 f 130.4262 0.9453300   194.3646    89.9   170.1181 2.465916          ?        ? 
1 1 1   13    1    7 o 334.3263 2.154267   356.4769   255.8   1118.082 14.40456          ?        ? 
1 1 1   13    1    8 o 123.1906 1.013059   215.4918    27.5   151.7741 2.495988          ?        ? 
1 1 1   13    1    9 f 24.76719 0.9106445   65.13894   262.8   6.134717 0.4510822          ?        ? 
1 1 1   13    1   10 o 84.96770 0.7963300   87.30789    85.5   72.20322 1.353247          ?        ? 
1 1 1   13    1   11 o 156.9512 1.130451   202.5920    15.3   246.4112 3.548513          ?        ? 
1 1 1   13    1   12 o 93.10168 0.8236582   167.7497    58.1   86.69799 1.533679          ?        ? 
1 1 1   13    1   13 o 24.14792 1.058531   44.30636   157.2   5.833996 0.5112265          ?        ? 
1 1 1   13    1   14 o 138.2632 1.011372   145.5616   131.2   191.2588 2.796710          ?        ? 
1 1 1   13    1   15 o 138.2408 1.207317   146.3233   164.2   191.2588 3.338008          ?        ? 
1 1 1   13    1   16 o 69.88737 0.8605888   78.08096   283.4   48.86723 1.202886          ?        ? 
1 1 1   13    1   17 o 82.09446 1.153881   99.42407   339.7   67.48189 1.894545          ?        ? 
1 1 1   13    1   18 o 66.67150 1.150176   64.52914   139.0   44.53685 1.533679          ?        ? 
1 1 1   13    1   19 o 8.475561 3.354653   3.261079   268.7  0.4210100 0.8420200          ?        ? 
1 1 1   13    1   20 o 28.09721 1.712463   36.82538   158.5   7.969118 0.9623086          ?        ? 
1 1 1   13    1   21 o 13.51684 3.072319   21.91224     9.2   1.984761 0.8119479          ?        ? 
1 1 1   13    1   22 o 27.16273 2.601710   34.66167   328.4   7.698469 1.413391          ?        ? 
1 1 1   13    1   23 o 15.11263 4.344468   12.61979    86.0   2.796710 1.383319          ?        ? 
1 1 1   13    2    0 o 752.6781 6.135780   687.3840   180.0   5670.043 92.35155   5670.043 92.35155 
1 1 1   13    2    1 o 310.4041 1.942457   310.5461   308.9   963.6318 12.05893          ?        ? 
1 1 1   13    2    2 o 126.2089 0.9650044   74.98439   123.7   159.2922 2.435844          ?        ? 
1 1 1   13    2    3 o 270.8598 1.704230   262.6155   346.5   733.7302 9.232149          ?        ? 
1 1 1   13    2    4 o 434.4700 2.557520   551.2079   146.2   1888.170 22.22332          ?        ? 
1 1 1   13    2    5 o 466.4623 2.714126   541.7776   146.9   2176.592 25.32075          ?        ? 
1 1 1   13    2    6 o 56.56495 0.6911311   78.58060   357.8   31.99676 0.7818757          ?        ? 
1 1 1   13    2    7 o 159.1250 1.322891   183.4050    76.0   253.2375 4.210100          ?        ? 
1 1 1   13    2    8 o 44.27700 1.154610   87.45828   192.3   19.60704 1.022453          ?        ? 
1 1 1   13    2    9 o 169.3280 1.207660   187.3616    98.2   286.7680 4.089812          ?        ? 
1 1 1   13    2   10 o 149.2100 1.098406   205.6846   193.9   222.6842 3.277864          ?        ? 
1 1 1   13    2   11 o 122.3121 1.008043   127.3410   358.4   149.6390 2.465916          ?        ? 
1 1 1   13    2   12 o 62.68756 0.7435578   98.16660   315.5   39.30429 0.9322364          ?        ? 
1 1 1   13    2   13 o 60.76276 0.6928751   76.02605   102.9   36.92860 0.8420200          ?        ? 
1 1 1   13    2   14 o 38.84724 0.8515241   67.80407    36.2   15.09622 0.6615872          ?        ? 
1 1 1   13    2   15 o 13.83887 2.594776   8.824055   207.4   1.984761 0.6916593          ?        ? 
1 1 1   13    2   16 o 102.1582 1.221629   106.8332   317.1   104.4706 2.495988          ?        ? 
1 1 1   13    2   17 o 31.56818 1.381284   49.96796    62.5   9.983953 0.8720922          ?        ? 
1 1 1   13    2   18 o 54.87375 1.068647   69.72386   139.0   30.16236 1.172814          ?        ? 
1 1 1   13    2   19 o 28.73510 1.517469   46.39039   157.0   8.299912 0.8720922          ?        ? 
1 1 1   13    2   20 o 22.12621 2.038678   40.82384   231.0   4.961904 0.9021643          ?        ? 
1 1 1   13    2   21 o 9.403891 3.322679   12.88762   236.6  0.8420200 0.7818757          ?        ? 
1 1 1   13    2   22 o 26.89975 2.179972   24.13849    30.7   7.457891 1.172814          ?        ? 
1 1 1   13    2   23 o 20.50511 2.859808   18.76230   166.8   4.540894 1.172814          ?        ? 
1 1 1   13    3    0 o 187.0731 1.945556   254.7486    -0.0   350.0999 7.277459   350.0999 7.277459 
1 1 1   13    3    1 o 347.6942 2.183878   439.1199     2.4   1209.111 15.18643          ?        ? 
1 1 1   13    3    2 o 395.0077 2.386693   409.1603   112.2   1560.624 18.85523          ?        ? 
1 1 1   13    3    3 o 260.0656 1.653551   268.3106   238.3   676.4128 8.600634          ?        ? 
1 1 1   13    3    4 o 17.42734 1.121622   65.69188    30.6   3.037287 0.3909379          ?        ? 
1 1 1   13    3    5 o 262.3690 1.753651   274.5830   256.6   688.4717 9.202076          ?        ? 
1 1 1   13    3    6 o 330.1952 2.349705   333.5205    72.2   1090.626 15.51723          ?        ? 
1 1 1   13    3    7 o 236.9670 1.783006   325.4554   122.2   561.6574 8.450273          ?        ? 
1 1 1   13    3    8 o 62.40108 1.084313   91.99226   326.7   38.94343 1.353247          ?        ? 
1 1 1   13    3    9 o 234.5549 1.955194   296.6025   173.8   550.4105 9.172004          ?        ? 
1 1 1   13    3   10 f 160.5352 1.161411   242.1620   272.6   257.7784 3.728946          ?        ? 
1 1 1   13    3   11 o 118.2889 0.9787709   149.2294   245.8   139.9558 2.315555          ?        ? 
1 1 1   13    3   12 o 42.04625 0.7867376   56.55029   103.5   17.68242 0.6615872          ?        ? 
1 1 1   13    3   13 o 51.96004 0.7523818   87.66426   156.2   27.00479 0.7818757          ?        ? 
1 1 1   13    3   14 o 30.27597 1.142258   42.72303   124.5   9.172004 0.6916593          ?        ? 
1 1 1   13    3   15 o 73.96565 0.8537950   79.87516   331.2   54.73130 1.263030          ?        ? 
1 1 1   13    3   16 o 34.61866 1.303003   54.29341   276.6   11.99879 0.9021643          ?        ? 
1 1 1   13    3   17 o 55.65444 0.9996232   54.94894   327.4   31.00438 1.112669          ?        ? 
1 1 1   13    3   18 o 106.6506 1.297057   106.6367     3.4   114.0336 2.766637          ?        ? 
1 1 1   13    3   19 o 22.08918 2.178236   28.89901   359.6   4.931832 0.9623086          ?        ? 
1 1 1   13    3   20 o 27.95706 1.559699   35.07782    19.7   7.878902 0.8720922          ?        ? 
1 1 1   13    3   21 o 53.66045 1.232914   54.89021    30.7   29.01962 1.323174          ?        ? 
1 1 1   13    3   22 o 23.93728 2.449764   26.44538   124.8   5.954284 1.172814          ?        ? 
1 1 1   13    3   23 o 9.343806 3.829532   7.115489    47.7  0.6014429 1.142741          ?        ? 
1 1 1   13    4    0 o 232.2042 2.176152   192.4005   180.0   539.3740 10.10424   539.3740 10.10424 
1 1 1   13    4    1 o 352.3401 2.219094   452.0777   116.7   1241.649 15.63752          ?        ? 
1 1 1   13    4    2 o 380.2238 2.341083   439.1555   173.8   1445.989 17.80271          ?        ? 
1 1 1   13    4    3 o 220.2648 1.576890   213.2266   189.7   485.2141 6.946666          ?        ? 
1 1 1   13    4    4 o 231.5047 1.617238   447.8722   128.7   536.0059 7.487964          ?        ? 
1 1 1   13    4    5 o 463.6737 2.921775   552.7390    25.8   2150.790 27.09500          ?        ? 
1 1 1   13    4    6 o 190.5841 1.522668   298.9413    56.3   363.2715 5.803924          ?        ? 
1 1 1   13    4    7 o 105.0639 1.144908   88.88425   276.9   110.3948 2.405771          ?        ? 
1 1 1   13    4    8 o 273.6949 2.038176   329.6719   156.2   749.3978 11.15676          ?        ? 
1 1 1   13    4    9 o 179.9954 1.603889   202.7798   158.1   324.0875 5.773852          ?        ? 
1 1 1   13    4   10 o 73.87138 1.058429   67.89042   343.8   54.58094 1.563751          ?        ? 
1 1 1   13    4   11 o 52.27976 0.7477805   135.8949    44.1   27.33558 0.7818757          ?        ? 
1 1 1   13    4   12 o 207.9942 1.467504   275.6331    89.0   432.9186 6.104645          ?        ? 
1 1 1   13    4   13 o 67.81905 0.9311764   91.31532    15.9   46.01038 1.263030          ?        ? 
1 1 1   13    4   14 o 30.86510 1.169171   21.97672   342.1   9.532870 0.7217315          ?        ? 
1 1 1   13    4   15 o 44.36872 1.016667   58.71967   264.1   19.69725 0.9021643          ?        ? 
1 1 1   13    4   16 f 95.62256 1.053535   115.6104   204.5   91.50953 2.014834          ?        ? 
1 1 1   13    4   17 o 13.00169 3.337200   23.35419   141.8   1.774257 0.8720922          ?        ? 
1 1 1   13    4   18 o 34.66462 1.518155   32.30159   279.1   12.05893 1.052525          ?        ? 
1 1 1   13    4   19 o 51.24058 1.203107   50.50403   337.2   26.34320 1.232958          ?        ? 
1 1 1   13    4   20 o 9.943130 3.616519   14.78496   354.5  0.8720922 0.9322364          ?        ? 
1 1 1   13    4   21 o 13.90393 3.554691   18.85133   103.1   2.135122 0.9923807          ?        ? 
1 1 1   13    4   22 o 22.23599 2.637196   22.57517   296.9   5.172409 1.172814          ?        ? 
1 1 1   13    4   23 o 24.20567 2.360483   19.57256   260.9   6.194862 1.142741          ?        ? 
1 1 1   13    5    0 o 93.44042 1.239543   230.4421   180.0   87.35958 2.315555   87.35958 2.315555 
1 1 1   13    5    1 o 150.7856 1.236506   215.6381    59.9   227.3755 3.728946          ?        ? 
1 1 1   13    5    2 o 128.6156 1.063854   166.8823    33.3   165.4269 2.736565          ?        ? 
1 1 1   13    5    3 o 392.2198 2.576168   462.4295   336.9   1538.792 20.20848          ?        ? 
1 1 1   13    5    4 o 292.7565 1.941421   275.2869   277.1   857.2065 11.36727          ?        ? 
1 1 1   13    5    5 o 66.37320 0.8834994   66.78784   271.7   44.05569 1.172814          ?        ? 
1 1 1   13    5    6 o 187.7065 1.513969   136.2964   184.3   352.3854 5.683635          ?        ? 
1 1 1   13    5    7 o 263.0392 1.989267   338.5478   252.3   692.1104 10.46511          ?        ? 
1 1 1   13    5    8 o 85.97073 1.014406   131.7007   267.2   73.91734 1.744184          ?        ? 
1 1 1   13    5    9 o 78.93036 1.066789   145.5164   326.4   62.30948 1.684040          ?        ? 
1 1 1   13    5   10 f 102.2424 1.161798   203.1651   181.5   104.5609 2.375700          ?        ? 
1 1 1   13    5   11 o 174.7161 1.273689   205.1888   125.3   305.3826 4.450677          ?        ? 
1 1 1   13    5   12 o 145.9707 1.246390   155.4814   150.8   213.1814 3.638730          ?        ? 
1 1 1   13    5   13 o 75.73439 0.9529773   101.5773   213.4   57.37765 1.443463          ?        ? 
1 1 1   13    5   14 o 61.87933 1.044858   85.81348   139.3   38.31191 1.293102          ?        ? 
1 1 1   13    5   15 o 69.27769 1.063499   99.88638   126.6   48.02522 1.473535          ?        ? 
1 1 1   13    5   16 o 9.950140 3.509802   26.55121   216.7  0.8720922 0.8720922          ?        ? 
1 1 1   13    5   17 o 12.94653 3.666306   22.74642   266.4   1.744184 0.9923807          ?        ? 
1 1 1   13    5   18 o 34.70439 1.559741   30.55610   283.7   12.08900 1.082597          ?        ? 
1 1 1   13    5   19 o 62.62769 1.104398   64.98756   167.6   39.33437 1.383319          ?        ? 
1 1 1   13    5   20 o 18.21366 2.641722   4.606032   347.8   3.398152 0.9623086          ?        ? 
1 1 1   13    5   21 o 34.24425 1.580699   31.55450   132.3   11.87850 1.082597          ?        ? 
1 1 1   13    5   22 o 29.20542 1.956386   40.29329   199.2   8.750995 1.142741          ?        ? 
1 1 1   13    5   23 o 17.10600 3.281434   17.13452   155.3   3.338008 1.082597          ?        ? 
1 1 1   13    6    0 o 201.5003 2.254175   250.8795    -0.0   406.2145 9.081788   406.2145 9.081788 
1 1 1   13    6    1 o 252.5536 1.899204   419.7521   168.4   637.9204 9.593014          ?        ? 
1 1 1   13    6    2 o 416.3328 2.928968   503.5822   342.9   1733.930 24.38851          ?        ? 
1 1 1   13    6    3 o 241.4500 1.861994   302.2086    92.2   583.0688 8.991571          ?        ? 
1 1 1   13    6    4 o 107.5695 1.034372   268.2358    59.4   115.7176 2.225339          ?        ? 
1 1 1   13    6    5 o 233.5126 1.648405   277.5247    44.3   545.3583 7.698469          ?        ? 
1 1 1   13    6    6 f 334.3382 2.442015   346.9868   310.8   1118.233 16.32917          ?        ? 
1 1 1   13    6    7 o 134.6857 1.216857   102.1989    72.4   181.4252 3.277864          ?        ? 
1 1 1   13    6    8 o 15.88935 2.271117   52.51624   191.9   2.526060 0.7217315          ?        ? 
1 1 1   13    6    9 o 44.03553 1.365813   40.77565    85.7   19.39653 1.202886          ?        ? 
1 1 1   13    6   10 o 150.8245 1.585111   160.3304   129.7   227.5860 4.781471          ?        ? 
1 1 1   13    6   11 o 26.80433 1.178010   25.22184   116.0   7.187243 0.6315150          ?        ? 
1 1 1   13    6   12 o 134.4784 1.308181   175.2452   223.9   180.9441 3.518441          ?        ? 
1 1 1   13    6   13 o 94.30870 1.084156   103.1354   346.9   88.98347 2.044906          ?        ? 
1 1 1   13    6   14 o 65.25954 1.013778   89.34612   246.7   42.61223 1.323174          ?        ? 
1 1 1   13    6   15 o 81.21243 1.166413   96.27654   281.1   66.00835 1.894545          ?        ? 
1 1 1   13    6   16 o 54.45239 1.159756   60.42070   136.1   29.68121 1.263030          ?        ? 
1 1 1   13    6   17 o 41.00036 1.283556   38.11058   351.6   16.84040 1.052525          ?        ? 
1 1 1   13    6   18 f 82.14099 0.9884807   92.60917    21.3   67.57211 1.623896          ?        ? 
1 1 1   13    6   19 o 59.19315 1.168479   69.91482   131.7   35.15434 1.383319          ?        ? 
1 1 1   13    6   20 o 40.88180 1.618293   40.07394   332.9   16.87047 1.323174          ?        ? 
1 1 1   13    6   21 o 29.57781 1.830083   34.81866   223.8   8.901355 1.082597          ?        ? 
1 1 1   13    6   22 o 17.28759 3.161771   25.30083   198.0   3.277864 1.052525          ?        ? 
1 1 1   13    6   23 o 12.68693 4.186160   14.87172   248.1   1.954689 1.232958          ?        ? 
1 1 1   13    7    0 o 222.0758 2.492320   341.3212   180.0   493.4238 11.06655   493.4238 11.06655 
1 1 1   13    7    1 o 377.8334 2.706095   428.0292   243.2   1428.006 20.44906          ?        ? 
1 1 1   13    7    2 o 248.3622 1.870714   281.6859   181.5   616.9301 9.292293          ?        ? 
1 1 1   13    7    3 o 308.5137 2.271150   333.8998    28.7   952.0240 14.01362          ?        ? 
1 1 1   13    7    4 o 192.9711 1.418122   300.2613   355.9   372.4135 5.473131          ?        ? 
1 1 1   13    7    5 o 216.9193 1.504167   243.1384    20.2   470.5990 6.525656          ?        ? 
1 1 1   13    7    6 o 264.1143 2.095031   315.7146   106.7   697.7640 11.06655          ?        ? 
1 1 1   13    7    7 o 276.0158 2.271625   288.5049    57.1   762.2086 12.54008          ?        ? 
1 1 1   13    7    8 o 34.41860 1.266891   126.6996   306.9   11.84843 0.8720922          ?        ? 
1 1 1   13    7    9 o 68.06852 1.038212   113.9648    19.1   46.34118 1.413391          ?        ? 
1 1 1   13    7   10 o 216.8742 2.038327   283.8550   342.8   470.7193 8.841210          ?        ? 
1 1 1   13    7   11 o 111.9953 1.382840   171.4837    70.6   125.4911 3.097431          ?        ? 
1 1 1   13    7   12 o 27.35476 1.429140   32.13965   280.9   7.487964 0.7818757          ?        ? 
1 1 1   13    7   13 o 82.36575 1.040549   81.44099   118.9   67.87283 1.714112          ?        ? 
1 1 1   13    7   14 o 74.38190 1.051164   84.19823    44.8   55.36282 1.563751          ?        ? 
1 1 1   13    7   15 o 69.10066 1.087983   71.79729    25.3   47.78464 1.503607          ?        ? 
1 1 1   13    7   16 o 42.80546 1.194302   51.75182    74.8   18.34401 1.022453          ?        ? 
1 1 1   13    7   17 o 29.78968 1.615171   41.05302   257.2   8.901355 0.9623086          ?        ? 
1 1 1   13    7   18 o 23.51049 2.046552   6.991316     3.7   5.563347 0.9623086          ?        ? 
1 1 1   13    7   19 o 39.62901 1.441799   34.83054    10.9   15.78788 1.142741          ?        ? 
1 1 1   13    7   20 o 45.49158 1.520412   39.19145   185.4   20.87007 1.383319          ?        ? 
1 1 1   13    7   21 o 41.73494 1.369047   53.00873   122.2   17.59221 1.142741          ?        ? 
1 1 1   13    7   22 o 10.20576 4.053095   7.771487   172.1  0.8119479 1.232958          ?        ? 
1 1 1   13    7   23 o 11.00632 4.134116   15.83176   186.0   1.323174 1.232958          ?        ? 
1 1 1   13    8    0 o 42.66040 1.342270   91.02227    -0.0   18.25379 1.142741   18.25379 1.142741 
1 1 1   13    8    1 o 322.9940 2.364850   404.3785   239.0   1043.503 15.27665          ?        ? 
1 1 1   13    8    2 o 105.7083 1.081033   173.0256   187.5   111.7481 2.285483          ?        ? 
1 1 1   13    8    3 o 526.2805 3.602734   563.8013   219.3   2771.328 37.92097          ?        ? 
1 1 1   13    8    4 o 283.8101 1.933746   248.4919   254.4   805.6328 10.97633          ?        ? 
1 1 1   13    8    5 o 105.0090 0.9307247   189.7002   355.5   110.2746 1.954689          ?        ? 
1 1 1   13    8    6 o 183.5824 1.482456   184.9769   167.3   337.0787 5.443058          ?        ? 
1 1 1   13    8    7 o 137.6191 1.365733   184.7986   312.5   189.4245 3.759018          ?        ? 
1 1 1   13    8    8 o 71.43176 1.136676   53.64553     4.5   51.03243 1.623896          ?        ? 
1 1 1   13    8    9 o 40.58978 1.222452   66.95252   325.4   16.47953 0.9923807          ?        ? 
1 1 1   13    8   10 o 149.1243 1.623349   205.8599    27.3   222.5038 4.841615          ?        ? 
1 1 1   13    8   11 o 142.3753 1.520766   174.1979     1.0   202.8366 4.330389          ?        ? 
1 1 1   13    8   12 o 112.1417 1.166505   166.3580   345.8   125.8219 2.616277          ?        ? 
1 1 1   13    8   13 o 20.27836 2.002006   35.32093    11.1   4.119884 0.8119479          ?        ? 
1 1 1   13    8   14 o 83.80232 1.094481   82.35107    10.6   70.27860 1.834401          ?        ? 
1 1 1   13    8   15 o 127.8881 1.328564   148.5977    55.0   163.7428 3.398152          ?        ? 
1 1 1   13    8   16 o 55.69441 1.322875   57.58915   142.6   31.06453 1.473535          ?        ? 
1 1 1   13    8   17 o 46.38919 1.264102   43.57608   239.4   21.56173 1.172814          ?        ? 
1 1 1   13    8   18 o 30.59481 1.818396   36.02500   301.3   9.412581 1.112669          ?        ? 
1 1 1   13    8   19 o 74.56020 1.129316   87.75372    20.5   55.78383 1.684040          ?        ? 
1 1 1   13    8   20 o 22.78267 2.309925   31.70075   131.5   5.292697 1.052525          ?        ? 
1 1 1   13    8   21 o 11.73131 3.812090   5.706707   117.6   1.473535 1.022453          ?        ? 
1 1 1   13    8   22 o 13.78380 3.944167   19.57591   200.6   2.195267 1.142741          ?        ? 
1 1 1   13    8   23 o 25.41536 2.188970   24.86293   283.1   6.826377 1.112669          ?        ? 
1 1 1   13    9    0 o 19.95447 2.154009   7.243819     0.0   4.119884 0.8420200   4.119884 0.8420200 
1 1 1   13    9    1 o 349.2531 2.617566   352.5600   232.3   1220.147 18.28386          ?        ? 
1 1 1   13    9    2 o 281.4819 2.190119   299.8656   262.8   792.4913 12.32958          ?        ? 
1 1 1   13    9    3 o 208.1480 1.610894   217.7794    79.9   433.3095 6.706088          ?        ? 
1 1 1   13    9    4 o 87.01603 0.9503813   117.7076    77.6   75.72166 1.653968          ?        ? 
1 1 1   13    9    5 o 154.3102 1.295960   146.1718   153.7   238.1413 3.999595          ?        ? 
1 1 1   13    9    6 o 54.03471 1.029588   20.78211   278.1   29.20005 1.112669          ?        ? 
1 1 1   13    9    7 o 112.8432 1.239202   134.0963   299.3   127.3555 2.796710          ?        ? 
1 1 1   13    9    8 o 11.94876 3.293543   52.06048   154.3   1.473535 0.8119479          ?        ? 
1 1 1   13    9    9 o 153.2814 1.471419   241.5080   333.4   235.0439 4.510822          ?        ? 
1 1 1   13    9   10 o 24.58203 1.101005   47.83125   214.9   6.044501 0.5412986          ?        ? 
1 1 1   13    9   11 o 173.9599 1.590388   216.2771    99.0   302.8566 5.533275          ?        ? 
1 1 1   13    9   12 o 9.495516 3.202800   34.23183   211.9  0.8420200 0.7217315          ?        ? 
1 1 1   13    9   13 o 40.76516 1.217192   38.15543   314.2   16.62990 0.9923807          ?        ? 
1 1 1   13    9   14 o 57.41623 1.099890   48.31891   239.0   32.98914 1.263030          ?        ? 
1 1 1   13    9   15 o 25.97477 2.083940   33.68627    82.0   6.766232 1.082597          ?        ? 
1 1 1   13    9   16 o 42.50394 1.521156   39.01949   166.7   18.10343 1.293102          ?        ? 
1 1 1   13    9   17 o 55.86047 1.372777   74.48341   238.0   31.27503 1.533679          ?        ? 
1 1 1   13    9   18 o 69.47173 1.147102   77.14328   241.4   48.38608 1.593824          ?        ? 
1 1 1   13    9   19 o 10.57262 3.691005   6.351242     3.9   1.052525 0.9623086          ?        ? 
1 1 1   13    9   20 f 24.56879 2.080797   24.27403   136.7   6.134717 1.022453          ?        ? 
1 1 1   13    9   21 o 11.61001 3.976716   14.55449   272.2   1.413391 1.112669          ?        ? 
1 1 1   13    9   22 o 29.48744 1.937675   38.59514   202.9   8.961499 1.142741          ?        ? 
1 1 1   13    9   23 o 9.550728 3.759952   5.348851    29.4  0.8420200 1.052525          ?        ? 
1 1 1   13   10    0 o 98.87267 2.207537   92.38169   180.0   97.91490 4.360461   97.91490 4.360461 
1 1 1   13   10    1 o 388.1055 3.161366   390.7761    35.2   1506.945 24.53887          ?        ? 
1 1 1   13   10    2 o 333.1808 2.676142   428.6037   244.8   1110.474 17.83278          ?        ? 
1 1 1   13   10    3 o 74.76721 0.9653049   157.8710   300.3   55.90411 1.443463          ?        ? 
1 1 1   13   10    4 o 94.77322 1.047111   145.6732   239.5   89.82550 1.984761          ?        ? 
1 1 1   13   10    5 o 16.44889 2.102449   40.85656   193.0   2.706493 0.6916593          ?        ? 
1 1 1   13   10    6 o 241.1118 1.858370   320.9554   142.0   581.5352 8.961499          ?        ? 
1 1 1   13   10    7 o 111.7736 1.116537   164.1801   287.6   124.9498 2.495988          ?        ? 
1 1 1   13   10    8 o 202.1277 1.614241   251.7537   218.7   408.7105 6.525656          ?        ? 
1 1 1   13   10    9 o 29.47743 1.020175   77.79954   287.1   8.690849 0.6014429          ?        ? 
1 1 1   13   10   10 o 20.58855 1.095468   21.95312   264.0   4.240172 0.4510822          ?        ? 
1 1 1   13   10   11 o 79.19232 0.8923787   108.8602   279.3   62.73050 1.413391          ?        ? 
1 1 1   13   10   12 o 33.25889 1.039811   57.09067   259.7   11.06655 0.6916593          ?        ? 
1 1 1   13   10   13 o 91.52155 1.117172   115.7370     5.1   83.81107 2.044906          ?        ? 
1 1 1   13   10   14 o 86.08614 1.100378   90.01859   112.8   74.15791 1.894545          ?        ? 
1 1 1   13   10   15 o 164.4588 1.535984   191.7334   125.8   270.8899 5.052120          ?        ? 
1 1 1   13   10   16 o 81.05828 1.224281   87.13377   260.1   65.79785 1.984761          ?        ? 
1 1 1   13   10   17 o 69.17092 1.239041   82.94253    80.6   47.93500 1.714112          ?        ? 
1 1 1   13   10   18 o 25.19713 2.028908   33.93422    69.7   6.405366 1.022453          ?        ? 
1 1 1   13   10   19 o 13.88672 3.637943   19.08356    92.5   2.074978 1.022453          ?        ? 
1 1 1   13   10   20 o 19.07846 2.837224   23.36998    52.0   3.759018 1.082597          ?        ? 
1 1 1   13   10   21 o 29.19539 2.060061   28.84445    25.0   8.750995 1.202886          ?        ? 
1 1 1   13   10   22 o 13.93397 3.786484   15.67899   287.2   2.255411 1.082597          ?        ? 
1 1 1   13   10   23 o 8.858955 3.796416   7.829538   255.6  0.3608657 1.202886          ?        ? 
1 1 1   13   11    0 o 129.7810 2.318799   186.4062   180.0   168.6145 6.014429   168.6145 6.014429 
1 1 1   13   11    1 o 148.0504 1.828089   212.7645    18.3   219.2259 5.412986          ?        ? 
1 1 1   13   11    2 o 134.1055 1.390303   138.7793    89.4   179.8615 3.728946          ?        ? 
1 1 1   13   11    3 o 122.9832 1.271517   74.08369   254.2   151.2629 3.127503          ?        ? 
1 1 1   13   11    4 o 176.7250 1.446390   235.0872   132.3   312.3593 5.112265          ?        ? 
1 1 1   13   11    5 o 154.9391 1.329517   145.4095   111.5   240.0960 4.119884          ?        ? 
1 1 1   13   11    6 o 117.0428 1.169045   98.21127   330.5   137.0087 2.736565          ?        ? 
1 1 1   13   11    7 o 186.2466 1.550056   181.9265    55.7   346.9724 5.773852          ?        ? 
1 1 1   13   11    8 o 32.99184 0.9115026   44.13105    99.7   10.88612 0.6014429          ?        ? 
1 1 1   13   11    9 o 40.18311 0.7857965   29.69435   113.1   16.14874 0.6315150          ?        ? 
1 1 1   13   11   10 o 24.58179 1.101015   39.91444   257.5   6.044501 0.5412986          ?        ? 
1 1 1   13   11   11 f 42.79029 0.8081966   75.00675   172.5   18.31394 0.6916593          ?        ? 
1 1 1   13   11   12 o 73.48045 0.8594328   98.22439   267.0   54.00957 1.263030          ?        ? 
1 1 1   13   11   13 o 150.0201 1.272884   157.2783    49.1   225.2404 3.819162          ?        ? 
1 1 1   13   11   14 f 47.50925 1.012759   37.28362    69.9   22.58418 0.9623086          ?        ? 
1 1 1   13   11   15 o 51.18008 1.263287   50.49473    99.8   26.22291 1.293102          ?        ? 
1 1 1   13   11   16 o 36.69802 1.638897   53.10511   258.2   13.50239 1.202886          ?        ? 
1 1 1   13   11   17 o 31.24372 1.780629   24.39013   313.1   9.803518 1.112669          ?        ? 
1 1 1   13   11   18 o 34.51705 1.786013   35.54435   345.3   11.99879 1.232958          ?        ? 
1 1 1   13   11   19 o 29.78094 1.868090   31.57855   102.2   8.961499 1.112669          ?        ? 
1 1 1   13   11   20 o 15.25636 3.601505   16.80056   302.8   2.556132 1.082597          ?        ? 
1 1 1   13   11   21 o 38.54105 1.716578   45.04651   165.7   15.12629 1.323174          ?        ? 
1 1 1   13   11   22 f 15.04584 4.019586   26.88907    72.0   2.676421 1.232958          ?        ? 
1 1 1   13   11   23 o 13.71086 4.145594   18.66386    16.3   2.375700 1.232958          ?        ? 
1 1 1   13   12    0 o 82.64931 2.058599   80.02007   180.0   68.44421 3.398152   68.44421 3.398152 
1 1 1   13   12    1 o 89.28026 1.599936   101.8003   231.4   79.72126 2.856854          ?        ? 
1 1 1   13   12    2 o 315.1084 2.638758   327.1704   162.8   993.3431 16.62990          ?        ? 
1 1 1   13   12    3 o 97.83173 1.229546   44.32740   124.1   95.71964 2.405771          ?        ? 
1 1 1   13   12    4 o 299.4738 2.204145   348.9645   298.1   897.1724 13.20167          ?        ? 
1 1 1   13   12    5 f 292.6405 2.147713   302.6068   234.5   856.7554 12.57016          ?        ? 
1 1 1   13   12    6 o 114.6029 1.115213   186.4167   326.9   131.3551 2.556132          ?        ? 
1 1 1   13   12    7 o 41.07042 1.098314   29.73501   150.2   16.87047 0.9021643          ?        ? 
1 1 1   13   12    8 o 170.3701 1.288528   190.5726    86.8   290.3466 4.390533          ?        ? 
1 1 1   13   12    9 o 163.9613 1.302211   199.7554   345.4   268.9352 4.270245          ?        ? 
1 1 1   13   12   10 o 241.6671 1.829213   279.5709   347.8   584.5724 8.841210          ?        ? 
1 1 1   13   12   11 o 113.6397 1.045277   122.2952   238.0   129.1899 2.375700          ?        ? 
1 1 1   13   12   12 o 66.36381 0.8609674   62.44203   220.2   44.05569 1.142741          ?        ? 
1 1 1   13   12   13 o 113.7273 1.110578   116.6260   255.6   129.4305 2.526060          ?        ? 
1 1 1   13   12   14 o 69.88558 0.9681872   74.27928   182.2   48.86723 1.353247          ?        ? 
1 1 1   13   12   15 f 76.82312 0.9981887   68.73226   227.4   59.06169 1.533679          ?        ? 
1 1 1   13   12   16 o 21.75091 2.073854   23.38360   219.9   4.751399 0.9021643          ?        ? 
1 1 1   13   12   17 o 34.69741 1.646724   49.69033   245.9   12.08900 1.142741          ?        ? 
1 1 1   13   12   18 o 37.87439 1.667393   51.08242   306.5   14.43463 1.263030          ?        ? 
1 1 1   13   12   19 o 7.009053 3.288094   7.059096    23.6  -1.142741 1.172814          ?        ? 
1 1 1   13   12   20 o 36.87980 1.590049   57.52055    64.0   13.77304 1.172814          ?        ? 
1 1 1   13   12   21 o 22.75158 2.709610   18.27110   115.6   5.412986 1.232958          ?        ? 
1 1 1   13   12   22 o 22.52072 2.603855   25.78263   219.4   5.382914 1.172814          ?        ? 
1 1 1   13   13    0 o 74.02431 1.912187   58.53563    -0.0   54.91174 2.826782   54.91174 2.826782 
1 1 1   13   13    1 o 354.1190 2.925529   350.7432   134.9   1254.670 20.71971          ?        ? 
1 1 1   13   13    2 o 256.3970 2.281241   266.4450    95.4   657.6177 11.69806          ?        ? 
1 1 1   13   13    3 o 136.6676 1.419249   170.1674   166.8   186.8082 3.879307          ?        ? 
1 1 1   13   13    4 o 225.9174 1.970046   246.1428   153.8   510.5649 8.901355          ?        ? 
1 1 1   13   13    5 o 203.4273 1.877409   219.2739   175.4   413.9731 7.638325          ?        ? 
1 1 1   13   13    6 o 153.2858 1.353667   159.3075   104.0   235.0138 4.149956          ?        ? 
1 1 1   13   13    7 o 91.04749 0.9743578   134.4641    59.6   82.90891 1.774257          ?        ? 
1 1 1   13   13    8 f 252.9656 1.795064   339.3652    85.8   640.2961 9.081788          ?        ? 
1 1 1   13   13    9 o 200.2345 1.486828   205.3905   236.4   401.1624 5.954284          ?        ? 
1 1 1   13   13   10 o 174.6159 1.446638   198.1299   181.9   305.1120 5.052120          ?        ? 
1 1 1   13   13   11 o 58.74669 0.8702218   55.02647    72.2   34.52282 1.022453          ?        ? 
1 1 1   13   13   12 o 173.2175 1.406235   195.9376   163.3   300.3305 4.871688          ?        ? 
1 1 1   13   13   13 o 38.72298 1.126066   33.80120   137.2   15.00600 0.8720922          ?        ? 
1 1 1   13   13   14 o 99.11298 1.061945   90.52893    45.8   98.30584 2.105050          ?        ? 
1 1 1   13   13   15 o 44.32383 1.153390   47.10647   211.1   19.66718 1.022453          ?        ? 
1 1 1   13   13   16 o 36.00418 1.378146   46.44761   176.4   12.99117 0.9923807          ?        ? 
1 1 1   13   13   17 o 36.02962 1.418906   35.68865   289.9   13.02124 1.022453          ?        ? 
1 1 1   13   13   18 o 37.42273 1.727696   39.38531    58.5   14.10384 1.293102          ?        ? 
1 1 1   13   13   19 o 36.78522 1.798514   41.75623   304.3   13.68283 1.323174          ?        ? 
1 1 1   13   13   20 o 8.662486 3.594579   9.887389   106.1  0.3007214 1.022453          ?        ? 
1 1 1   13   13   21 f 41.60283 1.590246   34.97706   143.4   17.59221 1.323174          ?        ? 
1 1 1   13   13   22 o 14.18031 3.832149   18.27363   288.0   2.375700 1.112669          ?        ? 
1 1 1   13   14    0 f 37.90929 1.753221   140.1428     0.0   14.46470 1.323174   14.46470 1.323174 
1 1 1   13   14    1 o 209.8159 1.934906   243.3555     7.8   440.3464 8.119479          ?        ? 
1 1 1   13   14    2 o 279.2886 2.384981   325.5665   357.3   780.3721 13.32196          ?        ? 
1 1 1   13   14    3 o 146.1894 1.429662   130.9604    55.5   213.7528 4.180028          ?        ? 
1 1 1   13   14    4 f 223.6317 2.003629   351.9466    61.7   500.3103 8.961499          ?        ? 
1 1 1   13   14    5 f 150.1114 1.532542   208.0554   341.0   225.3907 4.601038          ?        ? 
1 1 1   13   14    6 o 283.1236 2.384541   344.9754   216.3   802.2046 13.50239          ?        ? 
1 1 1   13   14    7 o 101.7892 0.9897087   138.1127   187.6   103.6286 2.014834          ?        ? 
1 1 1   13   14    8 o 46.20287 0.9763076   77.64452   170.2   21.35122 0.9021643          ?        ? 
1 1 1   13   14    9 o 43.65988 0.8954169   67.23659   340.9   19.06574 0.7818757          ?        ? 
1 1 1   13   14   10 o 69.53012 0.8650106   90.10768   309.4   48.35601 1.202886          ?        ? 
1 1 1   13   14   11 o 203.7939 1.593665   223.3523     5.4   415.7474 6.495584          ?        ? 
1 1 1   13   14   12 o 57.00438 0.9231968   82.89178   128.5   32.50799 1.052525          ?        ? 
1 1 1   13   14   13 o 121.8029 1.135702   146.3915   338.0   148.4662 2.766637          ?        ? 
1 1 1   13   14   14 o 65.76283 0.9602917   71.09948   114.9   43.27382 1.263030          ?        ? 
1 1 1   13   14   15 o 103.8731 1.129083   104.5809   347.8   108.0191 2.345627          ?        ? 
1 1 1   13   14   16 o 81.46750 1.052022   61.89680   163.9   66.45944 1.714112          ?        ? 
1 1 1   13   14   17 o 46.95528 1.216840   51.53363   304.3   22.10303 1.142741          ?        ? 
1 1 1   13   14   18 o 23.64071 2.098881   47.40331   116.0   5.653563 0.9923807          ?        ? 
1 1 1   13   14   19 o 29.33414 2.152833   33.79823   178.9   8.750995 1.263030          ?        ? 
1 1 1   13   14   20 o 34.39329 1.923594   31.20013   284.8   12.05893 1.323174          ?        ? 
1 1 1   13   14   21 o 16.97897 3.647207   20.64695   173.0   3.247792 1.202886          ?        ? 
1 1 1   13   14   22 o 29.03381 1.967950   28.95811    85.3   8.781067 1.142741          ?        ? 
1 1 1   13   15    0 o 114.2866 1.750730   64.66306   180.0   130.7236 3.999595   130.7236 3.999595 
1 1 1   13   15    1 o 306.6830 2.652418   314.1088   207.8   941.1379 16.26903          ?        ? 
1 1 1   13   15    2 o 110.3091 1.349454   65.24458   280.8   121.7020 2.977142          ?        ? 
1 1 1   13   15    3 o 211.2274 1.900620   231.3277   225.0   446.3307 8.029263          ?        ? 
1 1 1   13   15    4 o 69.92183 1.139718   87.30004   215.8   48.89731 1.593824          ?        ? 
1 1 1   13   15    5 o 240.3290 2.108425   281.3202    57.6   577.8964 10.13431          ?        ? 
1 1 1   13   15    6 o 131.9828 1.230385   138.8448   104.6   174.2380 3.247792          ?        ? 
1 1 1   13   15    7 o 201.1228 1.667163   266.2475    50.0   404.7109 6.706088          ?        ? 
1 1 1   13   15    8 f 141.0158 1.215546   108.4694   312.8   198.9272 3.428224          ?        ? 
1 1 1   13   15    9 o 73.86976 0.9159679   124.3393    81.1   54.58094 1.353247          ?        ? 
1 1 1   13   15   10 o 20.13808 1.717292   27.68732   107.8   4.059740 0.6916593          ?        ? 
1 1 1   13   15   11 o 90.42426 0.9478165   114.8912   242.5   81.79623 1.714112          ?        ? 
1 1 1   13   15   12 o 78.43742 1.015984   85.42226   320.8   61.55768 1.593824          ?        ? 
1 1 1   13   15   13 o 50.98803 1.002640   77.61510   177.6   26.01241 1.022453          ?        ? 
1 1 1   13   15   14 f 84.97840 1.008558   85.51460   202.2   72.26337 1.714112          ?        ? 
1 1 1   13   15   15 o 41.66129 1.227102   42.38564    91.3   17.38170 1.022453          ?        ? 
1 1 1   13   15   16 o 8.324593 3.368765   24.25310   102.4  0.3007214 0.8720922          ?        ? 
1 1 1   13   15   17 o 26.03996 1.790011   17.38050    15.5   6.826377 0.9322364          ?        ? 
1 1 1   13   15   18 o 38.43492 1.408351   41.71292   179.5   14.85564 1.082597          ?        ? 
1 1 1   13   15   19 o 50.87827 1.270781   48.52488   209.6   26.04248 1.293102          ?        ? 
1 1 1   13   15   20 o 16.74699 3.077983   14.72529   112.7   3.037287 0.9923807          ?        ? 
1 1 1   13   15   21 o 19.70462 2.823371   19.67994   338.6   4.119884 1.112669          ?        ? 
1 1 1   13   15   22 o 12.64945 4.080333   11.66726   215.8   1.954689 1.172814          ?        ? 
1 1 1   13   16    0 o 102.1026 1.694583   61.51651     0.0   104.3503 3.458297   104.3503 3.458297 
1 1 1   13   16    1 f 259.2807 2.110890   269.9279   330.0   672.5635 10.94626          ?        ? 
1 1 1   13   16    2 o 139.8702 1.462002   139.4721   101.1   195.6794 4.089812          ?        ? 
1 1 1   13   16    3 o 194.9764 1.819970   142.6355    13.5   380.2923 7.097026          ?        ? 
1 1 1   13   16    4 o 241.8823 2.206778   255.0589   201.3   585.4144 10.67561          ?        ? 
1 1 1   13   16    5 o 135.9055 1.449334   162.3611   354.6   184.7633 3.939451          ?        ? 
1 1 1   13   16    6 f 95.47700 1.102386   136.2578   121.5   91.17875 2.105050          ?        ? 
1 1 1   13   16    7 o 91.84798 1.113201   163.0604   220.1   84.38244 2.044906          ?        ? 
1 1 1   13   16    8 o 81.49319 1.033240   84.21192   107.2   66.42937 1.684040          ?        ? 
1 1 1   13   16    9 o 106.7656 1.098494   148.0257    90.3   114.0336 2.345627          ?        ? 
1 1 1   13   16   10 o 11.16516 3.023202   37.37149   182.8   1.293102 0.6916593          ?        ? 
1 1 1   13   16   11 o 87.30898 0.9644141   126.7716   168.7   76.26296 1.684040          ?        ? 
1 1 1   13   16   12 o 81.29429 1.017272   99.29145   124.7   66.12865 1.653968          ?        ? 
1 1 1   13   16   13 o 98.20018 1.071816   132.1547   161.5   96.50151 2.105050          ?        ? 
1 1 1   13   16   14 o 59.74592 1.057001   83.60561   271.8   35.72571 1.263030          ?        ? 
1 1 1   13   16   15 o 31.46578 1.529135   35.19390   277.0   9.923808 0.9623086          ?        ? 
1 1 1   13   16   16 o 11.49239 3.488879   8.698729    87.7   1.353247 0.8720922          ?        ? 
1 1 1   13   16   17 f 38.41919 1.408928   40.68663   334.6   14.82557 1.082597          ?        ? 
1 1 1   13   16   18 o 44.49797 1.351619   60.30740   177.5   19.90776 1.202886          ?        ? 
1 1 1   13   16   19 o 33.74206 1.648787   39.69024   350.1   11.51763 1.112669          ?        ? 
1 1 1   13   16   20 o 22.03990 2.524216   28.74012    16.9   5.052120 1.112669          ?        ? 
1 1 1   13   16   21 o 22.22862 2.502786   24.55628    10.5   5.202481 1.112669          ?        ? 
1 1 1   13   16   22 o 8.842813 3.817679   15.68948   100.3  0.3007214 1.232958          ?        ? 
1 1 1   13   17    0 f 374.0410 3.884164   317.8846    -0.0   1400.640 29.04969   1400.640 29.04969 
1 1 1   13   17    1 o 62.68848 1.175284   89.95582   344.1   39.30429 1.473535          ?        ? 
1 1 1   13   17    2 o 271.7140 2.130508   249.5641   299.2   738.6621 11.57778          ?        ? 
1 1 1   13   17    3 o 98.54562 1.296929   114.9156   119.6   97.13303 2.556132          ?        ? 
1 1 1   13   17    4 o 191.6327 1.836033   223.9454   320.5   367.4215 7.036882          ?        ? 
1 1 1   13   17    5 o 88.05428 1.212390   126.5064   290.5   77.55606 2.135122          ?        ? 
1 1 1   13   17    6 o 173.7307 1.505938   208.5808   168.7   301.9544 5.232553          ?        ? 
1 1 1   13   17    7 o 51.34771 1.054182   64.82097   302.6   26.37327 1.082597          ?        ? 
1 1 1   13   17    8 o 92.03983 1.094544   97.04172   177.1   84.74330 2.014834          ?        ? 
1 1 1   13   17    9 o 91.49487 1.150365   113.8186   187.6   83.75092 2.105050          ?        ? 
1 1 1   13   17   10 o 131.2549 1.179930   163.9346   206.6   172.3735 3.097431          ?        ? 
1 1 1   13   17   11 o 138.0572 1.154466   172.6611    76.1   190.7175 3.187647          ?        ? 
1 1 1   13   17   12 o 77.72269 1.044673   87.42129   234.7   60.44501 1.623896          ?        ? 
1 1 1   13   17   13 o 22.97856 1.897621   26.22154   324.4   5.292697 0.8720922          ?        ? 
1 1 1   13   17   14 o 68.57047 1.052540   75.34432   223.4   47.06291 1.443463          ?        ? 
1 1 1   13   17   15 o 40.37173 1.266298   45.45499    91.4   16.32917 1.022453          ?        ? 
1 1 1   13   17   16 o 13.28426 3.294380   10.55730    80.4   1.864473 0.8720922          ?        ? 
1 1 1   13   17   17 o 44.26286 1.290858   47.88023    55.8   19.66718 1.142741          ?        ? 
1 1 1   13   17   18 o 17.38524 2.767602   12.87572   246.5   3.097431 0.9623086          ?        ? 
1 1 1   13   17   19 o 11.41533 3.812089   12.15455   319.8   1.353247 1.022453          ?        ? 
1 1 1   13   17   20 o 7.074474 3.246900   6.249727   307.1 -0.6315150 1.052525          ?        ? 
1 1 1   13   17   21 o 26.91495 2.178740   31.58824   356.9   7.548109 1.172814          ?        ? 
1 1 1   13   17   22 o 11.52760 3.867745   5.162924   268.9   1.593824 1.052525          ?        ? 
1 1 1   13   18    0 o 189.0947 2.346535   154.2925   180.0   357.8585 8.871283   357.8585 8.871283 
1 1 1   13   18    1 o 19.61267 2.299953   60.99487   271.3   3.849235 0.9021643          ?        ? 
1 1 1   13   18    2 o 179.0276 1.620958   254.7583    82.0   320.6292 5.803924          ?        ? 
1 1 1   13   18    3 o 164.0928 1.447778   160.4653   329.1   269.3562 4.751399          ?        ? 
1 1 1   13   18    4 o 69.68018 1.229986   100.5384   282.4   48.56651 1.714112          ?        ? 
1 1 1   13   18    5 o 117.3434 1.178864   142.6332   344.5   137.7304 2.766637          ?        ? 
1 1 1   13   18    6 o 92.09189 1.093926   100.3855   315.6   84.83352 2.014834          ?        ? 
1 1 1   13   18    7 o 57.87097 1.065265   59.46867    84.8   33.50037 1.232958          ?        ? 
1 1 1   13   18    8 o 147.0733 1.482411   173.8405   151.0   216.4593 4.360461          ?        ? 
1 1 1   13   18    9 o 34.14734 1.232922   47.26467   244.6   11.66799 0.8420200          ?        ? 
1 1 1   13   18   10 o 101.1909 1.114434   109.0265    44.4   102.4558 2.255411          ?        ? 
1 1 1   13   18   11 o 20.64346 1.893761   33.43899   285.9   4.270245 0.7818757          ?        ? 
1 1 1   13   18   12 o 107.0717 1.123439   147.7277   201.7   114.7252 2.405771          ?        ? 
1 1 1   13   18   13 o 25.22204 1.788444   23.86240   104.3   6.375295 0.9021643          ?        ? 
1 1 1   13   18   14 o 30.25358 1.491004   43.00373    42.5   9.172004 0.9021643          ?        ? 
1 1 1   13   18   15 f 62.28192 1.158814   77.64753    54.2   38.85321 1.443463          ?        ? 
1 1 1   13   18   16 o 102.9419 1.153904   104.1509   257.4   106.2148 2.375700          ?        ? 
1 1 1   13   18   17 o 10.00782 3.565787   13.39697   105.4  0.9021643 0.9021643          ?        ? 
1 1 1   13   18   18 o 18.54757 2.513095   31.42608   305.0   3.518441 0.9322364          ?        ? 
1 1 1   13   18   19 o 50.17415 1.258646   53.89245   316.7   25.38089 1.263030          ?        ? 
1 1 1   13   18   20 o 11.40315 3.633801   2.202586    13.0   1.413391 0.9322364          ?        ? 
1 1 1   13   18   21 o 10.83313 3.949974   9.896508    87.5   1.232958 1.112669          ?        ? 
1 1 1   13   19    0 o 237.2422 2.713399   297.0677   180.0   563.4016 12.87088   563.4016 12.87088 
1 1 1   13   19    1 o 144.1065 1.429458   219.7209   112.7   207.7384 4.119884          ?        ? 
1 1 1   13   19    2 o 74.65975 1.147949   67.48304   221.7   55.75375 1.714112          ?        ? 
1 1 1   13   19    3 o 74.17546 1.094631   109.0113    97.4   55.03202 1.623896          ?        ? 
1 1 1   13   19    4 f 75.79676 1.229916   85.45651   132.7   57.46787 1.864473          ?        ? 
1 1 1   13   19    5 o 193.6781 1.684665   209.7034   353.0   375.3605 6.525656          ?        ? 
1 1 1   13   19    6 o 98.67698 1.142825   82.06519   236.2   97.40367 2.255411          ?        ? 
1 1 1   13   19    7 o 104.6166 1.149804   101.7390   148.9   109.4927 2.405771          ?        ? 
1 1 1   13   19    8 o 54.38731 1.022913   62.34026   137.4   29.59099 1.112669          ?        ? 
1 1 1   13   19    9 o 128.8448 1.283690   139.8347   299.1   166.1185 3.307936          ?        ? 
1 1 1   13   19   10 o 74.18523 1.033682   78.03667    20.1   55.06210 1.533679          ?        ? 
1 1 1   13   19   11 o 32.05011 1.454342   52.09795    81.2   10.28467 0.9322364          ?        ? 
1 1 1   13   19   12 f 60.72302 1.039993   90.39796   101.8   36.89852 1.263030          ?        ? 
1 1 1   13   19   13 o 19.88485 2.268471   17.75118   345.9   3.969523 0.9021643          ?        ? 
1 1 1   13   19   14 o 92.65519 1.071047   106.0454   352.3   85.94618 1.984761          ?        ? 
1 1 1   13   19   15 f 35.31701 1.490111   32.00694   330.3   12.51001 1.052525          ?        ? 
1 1 1   13   19   16 o 38.60642 1.479989   41.72617   179.5   14.97593 1.142741          ?        ? 
1 1 1   13   19   17 o 8.787501 3.431737   8.320900   228.9  0.5112265 0.8720922          ?        ? 
1 1 1   13   19   18 o 32.91986 1.644292   34.21316    62.0   10.94626 1.082597          ?        ? 
1 1 1   13   19   19 o 31.68831 1.660746   38.20061   320.5   10.19446 1.052525          ?        ? 
1 1 1   13   19   20 o 16.27938 3.517233   18.89535    79.9   2.977142 1.112669          ?        ? 
1 1 1   13   19   21 o 11.50173 3.867747   8.772175   138.1   1.533679 1.052525          ?        ? 
1 1 1   13   20    0 o 229.8260 2.742130   165.1280    -0.0   528.7886 12.60023   528.7886 12.60023 
1 1 1   13   20    1 o 77.66001 1.122962   87.66605   156.7   60.32472 1.744184          ?        ? 
1 1 1   13   20    2 o 121.5671 1.335802   150.7358   296.9   147.8347 3.247792          ?        ? 
1 1 1   13   20    3 o 73.23558 1.149742   86.08221    61.4   53.64870 1.684040          ?        ? 
1 1 1   13   20    4 o 17.06581 2.555087   19.41721   160.9   2.916998 0.8720922          ?        ? 
1 1 1   13   20    5 o 136.8006 1.340930   176.1235   127.4   187.2292 3.668802          ?        ? 
1 1 1   13   20    6 o 159.0078 1.446796   169.5187    22.0   252.9969 4.601038          ?        ? 
1 1 1   13   20    7 o 90.00577 1.135986   85.40559    62.8   81.04443 2.044906          ?        ? 
1 1 1   13   20    8 o 25.11511 1.676322   24.59914   225.3   6.315150 0.8420200          ?        ? 
1 1 1   13   20    9 o 71.56448 1.071537   83.92427   159.0   51.24293 1.533679          ?        ? 
1 1 1   13   20   10 o 93.25878 1.080238   108.5393    80.9   87.02879 2.014834          ?        ? 
1 1 1   13   20   11 o 60.87072 1.136276   65.85368    35.8   37.07896 1.383319          ?        ? 
1 1 1   13   20   12 o 44.28814 1.324072   53.66776     0.5   19.63711 1.172814          ?        ? 
1 1 1   13   20   13 o 32.36114 1.579754   36.17365   186.4   10.49518 1.022453          ?        ? 
1 1 1   13   20   14 o 76.03575 1.048075   88.98021   215.3   57.88888 1.593824          ?        ? 
1 1 1   13   20   15 o 67.92709 1.062509   73.19167   109.4   46.22089 1.443463          ?        ? 
1 1 1   13   20   16 o 68.50572 1.119380   81.99017   140.2   47.06291 1.533679          ?        ? 
1 1 1   13   20   17 o 32.18718 1.541578   29.44661   262.0   10.43503 0.9923807          ?        ? 
1 1 1   13   20   18 o 35.29432 1.618875   30.17253   262.7   12.60023 1.142741          ?        ? 
1 1 1   13   20   19 o 30.55903 1.820524   31.54801    90.2   9.532870 1.112669          ?        ? 
1 1 1   13   20   20 o 9.518039 3.716066   10.29261    21.2  0.7518036 1.022453          ?        ? 
1 1 1   13   20   21 o 10.51925 3.889088   8.483006    98.0   1.202886 1.082597          ?        ? 
1 1 1   13   21    0 o 17.80550 4.394026   9.726381   360.0   3.698874 1.353247   3.698874 1.353247 
1 1 1   13   21    1 o 59.68681 1.158814   48.62236   232.6   35.63549 1.383319          ?        ? 
1 1 1   13   21    2 o 109.2711 1.265952   135.8741     1.1   119.4466 2.766637          ?        ? 
1 1 1   13   21    3 o 139.4321 1.380326   146.2598   311.0   194.5066 3.849235          ?        ? 
1 1 1   13   21    4 o 171.5754 1.393403   170.4703     4.8   294.5266 4.781471          ?        ? 
1 1 1   13   21    5 o 151.7533 1.317795   188.9505   265.2   230.4128 3.999595          ?        ? 
1 1 1   13   21    6 o 80.11267 1.069813   77.86312   247.1   64.20403 1.714112          ?        ? 
1 1 1   13   21    7 o 28.68993 1.572267   53.53454   231.5   8.239767 0.9021643          ?        ? 
1 1 1   13   21    8 o 34.92783 1.377567   24.72850   310.1   12.20929 0.9623086          ?        ? 
1 1 1   13   21    9 o 77.95589 1.099412   75.83595    36.2   60.80587 1.714112          ?        ? 
1 1 1   13   21   10 o 48.00675 1.190188   45.25494   228.2   23.06533 1.142741          ?        ? 
1 1 1   13   21   11 o 35.59915 1.478301   31.35743    90.3   12.69044 1.052525          ?        ? 
1 1 1   13   21   12 o 128.7124 1.320056   131.2550    42.2   165.8779 3.398152          ?        ? 
1 1 1   13   21   13 o 9.929075 3.755853   29.75031    95.0  0.7217315 1.022453          ?        ? 
1 1 1   13   21   14 o 85.38397 1.127037   81.67195     3.0   73.01517 1.924617          ?        ? 
1 1 1   13   21   15 o 20.71282 2.322978   18.64302    39.0   4.330389 0.9623086          ?        ? 
1 1 1   13   21   16 o 24.22729 1.923938   21.57924   192.0   5.924213 0.9322364          ?        ? 
1 1 1   13   21   17 o 27.03189 1.891198   30.45878   269.4   7.397748 1.022453          ?        ? 
1 1 1   13   21   18 o 47.41380 1.300210   51.46903   330.2   22.67440 1.232958          ?        ? 
1 1 1   13   21   19 o 27.63511 1.958735   22.25354   250.3   7.818758 1.082597          ?        ? 
1 1 1   13   21   20 f 20.91134 2.588541   23.71872   352.4   4.631110 1.082597          ?        ? 
1 1 1   13   21   21 o 17.49091 3.301322   22.14834    31.6   3.548513 1.112669          ?        ? 
1 1 1   13   22    0 o 65.44183 1.564369   85.90061    -0.0   42.91295 2.044906   42.91295 2.044906 
1 1 1   13   22    1 o 76.87946 1.075689   72.34515    98.1   59.12184 1.653968          ?        ? 
1 1 1   13   22    2 o 37.18243 1.496230   35.20287    57.4   13.83319 1.112669          ?        ? 
1 1 1   13   22    3 o 125.4186 1.270803   143.3579   248.9   157.3675 3.187647          ?        ? 
1 1 1   13   22    4 o 90.87327 1.042411   92.00961   191.8   82.60818 1.894545          ?        ? 
1 1 1   13   22    5 o 116.2025 1.112801   122.9297   132.7   135.0841 2.586205          ?        ? 
1 1 1   13   22    6 o 24.32354 1.792692   29.01118   324.5   5.924213 0.8720922          ?        ? 
1 1 1   13   22    7 o 156.5885 1.497956   170.6880   281.7   245.4188 4.691255          ?        ? 
1 1 1   13   22    8 o 140.9767 1.386534   167.3245   270.0   198.9272 3.909379          ?        ? 
1 1 1   13   22    9 o 127.0374 1.301953   127.8254   229.2   161.5476 3.307936          ?        ? 
1 1 1   13   22   10 o 25.16565 1.852200   19.30501   293.5   6.345222 0.9322364          ?        ? 
1 1 1   13   22   11 o 42.94231 1.400584   32.43624   198.8   18.46430 1.202886          ?        ? 
1 1 1   13   22   12 o 39.62549 1.403982   73.08691   199.0   15.72773 1.112669          ?        ? 
1 1 1   13   22   13 f 27.57483 2.072074   25.37132   180.0   7.638325 1.142741          ?        ? 
1 1 1   13   22   14 f 58.49370 1.156746   63.72767   219.9   34.28225 1.353247          ?        ? 
1 1 1   13   22   15 o 11.45200 3.812089   2.385677   103.5   1.293102 1.022453          ?        ? 
1 1 1   13   22   16 o 32.69081 1.609818   29.22116    13.6   10.76583 1.052525          ?        ? 
1 1 1   13   22   17 o 46.27574 1.364679   47.01463   207.2   21.56173 1.263030          ?        ? 
1 1 1   13   22   18 o 20.65500 2.620666   8.775662   162.5   4.420605 1.082597          ?        ? 
1 1 1   13   22   19 o 19.16786 2.667103   22.52514   104.3   3.849235 1.022453          ?        ? 
1 1 1   13   22   20 o 40.16452 1.684629   35.48730   342.3   16.56975 1.353247          ?        ? 
1 1 1   13   23    0 o 51.92504 1.741733   6.675359   180.0   27.06493 1.804329   27.06493 1.804329 
1 1 1   13   23    1 o 22.98879 2.223808   53.69882   349.2   5.292697 1.022453          ?        ? 
1 1 1   13   23    2 o 247.5789 2.083123   266.0252   125.1   613.8026 10.31474          ?        ? 
1 1 1   13   23    3 o 91.29793 1.169316   85.20395   153.3   83.39005 2.135122          ?        ? 
1 1 1   13   23    4 o 196.1335 1.533249   227.3761    61.4   384.9836 6.014429          ?        ? 
1 1 1   13   23    5 o 138.9435 1.266140   139.1572    86.5   193.1835 3.518441          ?        ? 
1 1 1   13   23    6 o 92.03617 1.045577   142.9473   190.2   84.74330 1.924617          ?        ? 
1 1 1   13   23    7 o 34.23098 1.361686   29.67874    35.2   11.72814 0.9322364          ?        ? 
1 1 1   13   23    8 o 80.38223 1.103637   107.7108     3.2   64.65511 1.774257          ?        ? 
1 1 1   13   23    9 o 68.46790 1.141960   75.14903   273.3   46.91254 1.563751          ?        ? 
1 1 1   13   23   10 o 43.11890 1.359976   43.19923   226.1   18.61466 1.172814          ?        ? 
1 1 1   13   23   11 o 67.13326 1.097470   62.77283   236.3   45.10822 1.473535          ?        ? 
1 1 1   13   23   12 f 60.18236 1.174257   58.45586   332.6   36.26701 1.413391          ?        ? 
1 1 1   13   23   13 o 56.74385 1.324908   69.47604   117.2   32.26741 1.503607          ?        ? 
1 1 1   13   23   14 o 48.75124 1.172013   31.72099   317.8   23.81714 1.142741          ?        ? 
1 1 1   13   23   15 f 10.60967 3.692243   19.53616   283.5   1.052525 0.9623086          ?        ? 
1 1 1   13   23   16 o 16.94767 3.037845   10.43835   295.2   3.037287 0.9923807          ?        ? 
1 1 1   13   23   17 o 7.519718 3.309278   13.56736   219.8 -0.1804329 0.9623086          ?        ? 
1 1 1   13   23   18 o 12.64108 3.897292   24.54994   230.5   1.774257 1.082597          ?        ? 
1 1 1   13   23   19 o 23.89578 2.202324   20.88039    59.2   5.924213 1.052525          ?        ? 
1 1 1   13   23   20 o 32.00369 1.785328   31.56059   245.6   10.61547 1.142741          ?        ? 
1 1 1   13   24    0 o 70.54244 1.600451   69.03854    -0.0   49.85962 2.255411   49.85962 2.255411 
1 1 1   13   24    1 o 105.0701 1.273636   117.5860    19.2   110.4550 2.676421          ?        ? 
1 1 1   13   24    2 o 8.441059 3.494018   26.12410   273.2  0.1804329 0.9623086          ?        ? 
1 1 1   13   24    3 o 97.27446 1.097473   81.66363   348.1   94.66711 2.135122          ?        ? 
1 1 1   13   24    4 o 79.27907 1.043130   62.89439   242.3   62.88086 1.653968          ?        ? 
1 1 1   13   24    5 o 96.78152 1.009846   92.18774   242.1   93.70480 1.954689          ?        ? 
1 1 1   13   24    6 o 47.28580 1.144738   75.60863   185.7   22.37368 1.082597          ?        ? 
1 1 1   13   24    7 o 147.4737 1.274471   143.8433   304.0   217.6622 3.759018          ?        ? 
1 1 1   13   24    8 o 73.20151 1.047574   76.83714   345.6   53.61863 1.533679          ?        ? 
1 1 1   13   24    9 o 33.46986 1.482499   27.56768   286.2   11.21691 0.9923807          ?        ? 
1 1 1   13   24   10 o 36.09484 1.624628   25.19846   122.0   13.05131 1.172814          ?        ? 
1 1 1   13   24   11 o 47.73786 1.354378   38.44920   271.3   22.82476 1.293102          ?        ? 
1 1 1   13   24   12 o 113.0574 1.303351   112.4853    28.6   128.0472 2.947070          ?        ? 
1 1 1   13   24   13 o 84.97839 1.309356   79.42214   321.3   72.38365 2.225339          ?        ? 
1 1 1   13   24   14 o 36.96878 1.626894   42.78442    83.6   13.74297 1.202886          ?        ? 
1 1 1   13   24   15 o 39.45889 1.524227   46.48670   322.3   15.66759 1.202886          ?        ? 
1 1 1   13   24   16 o 31.20053 1.686710   25.36585   178.2   9.833591 1.052525          ?        ? 
1 1 1   13   24   17 o 31.91621 1.743110   26.13947   120.0   10.34482 1.112669          ?        ? 
1 1 1   13   24   18 o 21.14077 2.418202   27.76330    71.9   4.631110 1.022453          ?        ? 
1 1 1   13   24   19 o 49.31025 1.433161   51.52037   250.2   24.74938 1.413391          ?        ? 
1 1 1   13   24   20 o 25.80744 2.155714   23.57162   210.7   7.036882 1.112669          ?        ? 
1 1 1   13   25    0 o 81.36362 1.775972   32.40276   180.0   66.33915 2.886926   66.33915 2.886926 
1 1 1   13   25    1 o 100.3661 1.258423   116.7047   172.8   100.8018 2.526060          ?        ? 
1 1 1   13   25    2 o 34.22623 1.669395   54.00458   340.0   11.72814 1.142741          ?        ? 
1 1 1   13   25    3 o 100.6611 1.075488   127.9120    70.2   101.3732 2.165194          ?        ? 
1 1 1   13   25    4 o 61.24712 1.055643   61.01796   199.1   37.53004 1.293102          ?        ? 
1 1 1   13   25    5 o 64.68473 0.9762969   72.36667   351.9   41.86042 1.263030          ?        ? 
1 1 1   13   25    6 o 68.16632 1.036722   79.76738   300.7   46.49154 1.413391          ?        ? 
1 1 1   13   25    7 o 94.02688 1.087405   95.33058    20.1   88.47225 2.044906          ?        ? 
1 1 1   13   25    8 o 41.99503 1.288959   50.93703   174.6   17.65235 1.082597          ?        ? 
1 1 1   13   25    9 o 93.25330 1.080302   80.53240   105.0   87.02879 2.014834          ?        ? 
1 1 1   13   25   10 o 75.39859 1.036990   63.10879   351.2   56.89650 1.563751          ?        ? 
1 1 1   13   25   11 o 114.8224 1.270222   115.6007    21.9   132.0468 2.916998          ?        ? 
1 1 1   13   25   12 o 91.64471 1.230519   93.29527   256.8   84.14186 2.255411          ?        ? 
1 1 1   13   25   13 o 52.85581 1.450814   50.02799   354.3   28.02724 1.533679          ?        ? 
1 1 1   13   25   14 o 54.96399 1.395167   57.00486   242.2   30.34279 1.533679          ?        ? 
1 1 1   13   25   15 o 36.41335 1.775589   45.55897   233.6   13.38210 1.293102          ?        ? 
1 1 1   13   25   16 o 31.21971 1.781998   33.78762    67.6   9.863664 1.112669          ?        ? 
1 1 1   13   25   17 o 24.87480 2.176093   32.07151   345.6   6.345222 1.082597          ?        ? 
1 1 1   13   25   18 o 16.86889 3.235123   24.68227   153.1   3.127503 1.052525          ?        ? 
1 1 1   13   25   19 f 10.67541 3.943550   10.80124   127.6   1.172814 1.112669          ?        ? 
1 1 1   13   25   20 o 7.096543 3.288860   11.31524   292.6 -0.5713707 1.112669          ?        ? 
1 1 1   13   26    0 o 215.2209 2.648725   183.8105     0.0   464.0733 11.39734   464.0733 11.39734 
1 1 1   13   26    1 o 146.1175 1.461237   170.2726   168.1   213.6927 4.270245          ?        ? 
1 1 1   13   26    2 o 69.92713 1.161134   137.3728   104.6   48.92738 1.623896          ?        ? 
1 1 1   13   26    3 o 135.9878 1.238376   161.3506   153.8   185.0640 3.368080          ?        ? 
1 1 1   13   26    4 o 120.1276 1.214125   115.2642   271.7   144.4064 2.916998          ?        ? 
1 1 1   13   26    5 o 87.47149 1.117329   121.2617   227.7   76.56368 1.954689          ?        ? 
1 1 1   13   26    6 o 108.9652 1.076319   116.1855   335.5   118.8150 2.345627          ?        ? 
1 1 1   13   26    7 o 29.25061 1.747746   40.06279     0.4   8.570561 1.022453          ?        ? 
1 1 1   13   26    8 o 126.5186 1.212217   141.6849   155.4   160.2244 3.067359          ?        ? 
1 1 1   13   26    9 o 56.29928 1.148418   59.32425   235.7   31.72611 1.293102          ?        ? 
1 1 1   13   26   10 o 57.16646 1.130997   60.78807   312.7   32.71849 1.293102          ?        ? 
1 1 1   13   26   11 o 60.49913 1.168108   54.27824   249.8   36.65794 1.413391          ?        ? 
1 1 1   13   26   12 o 111.8279 1.263898   114.0841    72.7   125.3407 2.826782          ?        ? 
1 1 1   13   26   13 o 24.05179 2.563132   17.94336   298.8   5.864068 1.232958          ?        ? 
1 1 1   13   26   14 o 26.26398 2.461741   22.33259   348.1   7.006810 1.293102          ?        ? 
1 1 1   13   26   15 o 36.58405 1.808403   45.40501     2.3   13.53246 1.323174          ?        ? 
1 1 1   13   26   16 o 31.90378 1.838048   26.70962   318.4   10.34482 1.172814          ?        ? 
1 1 1   13   26   17 f 13.29289 3.779424   21.30490   109.7   1.984761 1.052525          ?        ? 
1 1 1   13   26   18 o 20.43221 2.722832   22.33116   190.2   4.420605 1.112669          ?        ? 
1 1 1   13   26   19 o 29.99862 2.004902   28.15735   233.2   9.412581 1.202886          ?        ? 
1 1 1   13   27    0 o 61.60128 1.785144   38.26923   180.0   38.07133 2.195267   38.07133 2.195267 
1 1 1   13   27    1 f 114.2887 1.302466   112.8995   123.5   130.7236 2.977142          ?        ? 
1 1 1   13   27    2 o 91.61249 1.263777   98.91904   155.1   83.99149 2.315555          ?        ? 
1 1 1   13   27    3 o 64.79528 1.113864   71.59109   147.1   42.01078 1.443463          ?        ? 
1 1 1   13   27    4 o 229.0723 1.745997   215.4294   161.8   525.6912 7.999191          ?        ? 
1 1 1   13   27    5 o 76.49375 1.061457   101.9701   152.1   58.55046 1.623896          ?        ? 
1 1 1   13   27    6 o 24.92207 1.990968   37.98482   121.6   6.224934 0.9923807          ?        ? 
1 1 1   13   27    7 o 144.7381 1.298558   135.5794    97.3   209.7231 3.759018          ?        ? 
1 1 1   13   27    8 o 114.9622 1.164044   132.1256    79.1   132.2874 2.676421          ?        ? 
1 1 1   13   27    9 o 45.85016 1.246170   46.58031   294.8   21.05050 1.142741          ?        ? 
1 1 1   13   27   10 o 86.79233 1.108749   79.59467   117.5   75.42094 1.924617          ?        ? 
1 1 1   13   27   11 o 59.84868 1.155680   62.69655   284.6   35.87607 1.383319          ?        ? 
1 1 1   13   27   12 o 62.02789 1.139319   62.77740   103.7   38.55249 1.413391          ?        ? 
1 1 1   13   27   13 o 30.94437 1.895036   44.62794   175.3   9.653158 1.172814          ?        ? 
1 1 1   13   27   14 o 28.08640 2.194937   28.95937   193.8   7.999191 1.232958          ?        ? 
1 1 1   13   27   15 o 27.10581 2.274343   37.38644    72.7   7.487964 1.232958          ?        ? 
1 1 1   13   27   16 o 12.54180 4.134794   16.37502   132.7   1.684040 1.202886          ?        ? 
1 1 1   13   27   17 o 20.03640 2.551488   14.60922    65.9   4.180028 1.022453          ?        ? 
1 1 1   13   27   18 o 17.38926 3.318261   16.11946   148.1   3.398152 1.112669          ?        ? 
1 1 1   13   27   19 o 8.181836 3.603402   8.510486   284.5       0.06 1.142741          ?        ? 
1 1 1   13   28    0 o 6.443751 4.308313   4.205995   180.0 -0.3909379 1.473535 -0.3909379 1.473535 
1 1 1   13   28    1 o 111.6573 1.306228   114.4278   331.6   124.7994 2.916998          ?        ? 
1 1 1   13   28    2 o 31.85090 1.793892   50.19628   265.9   10.16438 1.142741          ?        ? 
1 1 1   13   28    3 o 79.00745 1.027685   74.74840   101.4   62.45984 1.623896          ?        ? 
1 1 1   13   28    4 o 69.66819 1.057538   64.02744    14.8   48.56651 1.473535          ?        ? 
1 1 1   13   28    5 o 114.0272 1.147216   100.1504   350.7   130.1222 2.616277          ?        ? 
1 1 1   13   28    6 o 49.66425 1.211018   48.73364   168.0   24.68923 1.202886          ?        ? 
1 1 1   13   28    7 o 123.4053 1.181877   150.4740   127.8   152.4357 2.916998          ?        ? 
1 1 1   13   28    8 f 55.24352 1.170366   68.91496   115.0   30.55330 1.293102          ?        ? 
1 1 1   13   28    9 o 38.19046 1.456737   51.50271   108.9   14.61506 1.112669          ?        ? 
1 1 1   13   28   10 o 65.13061 1.177388   61.72367   193.4   42.49194 1.533679          ?        ? 
1 1 1   13   28   11 o 44.24770 1.393245   46.11433    95.2   19.63711 1.232958          ?        ? 
1 1 1   13   28   12 o 26.52616 1.983938   14.64701   322.0   7.097026 1.052525          ?        ? 
1 1 1   13   28   13 o 34.52628 1.567787   38.74751   334.6   11.99879 1.082597          ?        ? 
1 1 1   13   28   14 o 50.69557 1.364339   55.38968   326.6   25.86205 1.383319          ?        ? 
1 1 1   13   28   15 o 40.24258 1.606634   36.13939     4.8   16.38932 1.293102          ?        ? 
1 1 1   13   28   16 o 8.422247 3.721948   6.676140   102.0 -0.1804329 1.232958          ?        ? 
1 1 1   13   28   17 o 10.43595 3.963869   20.79638   312.5  0.9923807 1.142741          ?        ? 
1 1 1   13   28   18 o 17.76361 3.423331   16.50389   127.9   3.608657 1.172814          ?        ? 
1 1 1   13   29    0 o 109.6366 1.674039   127.4701   180.0   120.3788 3.668802   120.3788 3.668802 
1 1 1   13   29    1 o 111.2677 1.337828   91.24256    89.3   123.9273 2.977142          ?        ? 
1 1 1   13   29    2 o 98.37131 1.085236   111.5671   290.7   96.83231 2.135122          ?        ? 
1 1 1   13   29    3 o 106.5902 1.156727   88.56219   284.0   113.7028 2.465916          ?        ? 
1 1 1   13   29    4 o 60.89098 1.160591   55.38117   317.4   37.10903 1.413391          ?        ? 
1 1 1   13   29    5 o 118.9870 1.137306   124.9312     0.1   141.7000 2.706493          ?        ? 
1 1 1   13   29    6 o 117.8812 1.122464   120.7612     8.2   139.0837 2.646349          ?        ? 
1 1 1   13   29    7 o 13.03941 3.872977   31.06208   118.6   1.744184 1.082597          ?        ? 
1 1 1   13   29    8 o 89.40350 1.093184   93.12371   234.6   80.02198 1.954689          ?        ? 
1 1 1   13   29    9 o 48.44628 1.272500   54.59302   167.6   23.51642 1.232958          ?        ? 
1 1 1   13   29   10 o 39.02898 1.425440   47.97413    94.8   15.27665 1.112669          ?        ? 
1 1 1   13   29   11 o 22.09183 2.382159   35.51847   213.2   4.931832 1.052525          ?        ? 
1 1 1   13   29   12 o 23.51351 2.238128   24.76179   208.5   5.593419 1.052525          ?        ? 
1 1 1   13   29   13 o 29.68924 1.823215   42.75528   159.1   8.901355 1.082597          ?        ? 
1 1 1   13   29   14 o 6.535670 3.123938   13.45448    57.6  -1.443463 1.142741          ?        ? 
1 1 1   13   29   15 o 28.23339 2.076998   29.70859    42.3   8.149551 1.172814          ?        ? 
1 1 1   13   29   16 o 10.31060 3.912797   19.13732   119.3  0.9322364 1.112669          ?        ? 
1 1 1   13   29   17 o 11.33079 4.015566   11.36072    76.6   1.383319 1.142741          ?        ? 
1 1 1   13   29   18 o 16.22117 3.266311   8.166290    79.7   3.037287 1.022453          ?        ? 
1 1 1   13   30    0 o 13.87349 5.961825   12.34140   180.0   2.766637 1.684040   2.766637 1.684040 
1 1 1   13   30    1 o 127.1886 1.383159   110.6252   235.9   161.9686 3.518441          ?        ? 
1 1 1   13   30    2 o 55.98015 1.154965   83.31326   184.1   31.36525 1.293102          ?        ? 
1 1 1   13   30    3 o 28.56622 1.894891   30.86758   291.3   8.179624 1.082597          ?        ? 
1 1 1   13   30    4 o 131.7923 1.254981   120.4987   305.5   173.8772 3.307936          ?        ? 
1 1 1   13   30    5 o 53.19318 1.243744   23.15393   183.4   28.32796 1.323174          ?        ? 
1 1 1   13   30    6 o 6.577774 3.104738   21.45225   240.1  -1.263030 1.082597          ?        ? 
1 1 1   13   30    7 o 73.56735 1.144557   55.76505   358.6   54.19000 1.684040          ?        ? 
1 1 1   13   30    8 o 84.23416 1.124571   84.67979   305.2   71.06048 1.894545          ?        ? 
1 1 1   13   30    9 o 20.63413 2.769057   16.01221   350.7   4.300317 1.142741          ?        ? 
1 1 1   13   30   10 f 17.56633 2.910263   25.32036   284.3   3.127503 1.022453          ?        ? 
1 1 1   13   30   11 o 9.290332 3.653003   15.27665   199.8  0.5412986 0.9923807          ?        ? 
1 1 1   13   30   12 o 65.82626 1.119261   58.77531   359.5   43.48432 1.473535          ?        ? 
1 1 1   13   30   13 f 40.82269 1.399640   30.33327   180.5   16.78026 1.142741          ?        ? 
1 1 1   13   30   14 o 33.10025 1.953312   33.04469   115.2   11.15676 1.293102          ?        ? 
1 1 1   13   30   15 f 31.72145 1.896014   36.11649   208.9   10.28467 1.202886          ?        ? 
1 1 1   13   30   16 o 8.364120 3.667257   4.737633    91.5      -0.06 1.172814          ?        ? 
1 1 1   13   30   17 o 29.35668 2.048743   28.76672    21.7   8.961499 1.202886          ?        ? 
1 1 1   13   30   18 o 11.16806 3.913369   6.755624   126.8   1.473535 1.082597          ?        ? 
1 1 1   13   31    0 o 82.57197 1.804674   114.7337   180.0   68.35399 2.977142   68.35399 2.977142 
1 1 1   13   31    1 o 81.97297 1.283990   79.83297   310.4   67.27139 2.105050          ?        ? 
1 1 1   13   31    2 o 8.512963 3.623320   11.34028   174.9   0.000000 1.082597          ?        ? 
1 1 1   13   31    3 o 91.00861 1.156512   75.33641   169.7   82.90891 2.105050          ?        ? 
1 1 1   13   31    4 o 104.2651 1.153680   115.4724   329.2   108.8311 2.405771          ?        ? 
1 1 1   13   31    5 o 43.69089 1.445416   54.13210    85.6   19.12588 1.263030          ?        ? 
1 1 1   13   31    6 o 55.25824 1.278896   42.00349   298.0   30.58337 1.413391          ?        ? 
1 1 1   13   31    7 o 79.94912 1.166037   85.03916   289.6   64.02360 1.864473          ?        ? 
1 1 1   13   31    8 o 27.83707 1.998539   26.95725   217.5   7.788685 1.112669          ?        ? 
1 1 1   13   31    9 o 26.67325 1.972997   35.46708   212.6   7.157170 1.052525          ?        ? 
1 1 1   13   31   10 o 32.66606 1.657067   39.89870   214.5   10.73576 1.082597          ?        ? 
1 1 1   13   31   11 o 76.49911 1.081037   58.09230   251.6   58.70082 1.653968          ?        ? 
1 1 1   13   31   12 o 35.59722 1.647339   29.82406   194.2   12.78066 1.172814          ?        ? 
1 1 1   13   31   13 o 29.37824 1.893697   29.07159   106.0   8.750995 1.112669          ?        ? 
1 1 1   13   31   14 o 52.64359 1.399539   58.87281   100.5   27.99717 1.473535          ?        ? 
1 1 1   13   31   15 o 17.36132 3.664723   23.20118   134.7   3.368080 1.232958          ?        ? 
1 1 1   13   31   16 o 28.07424 2.303005   32.78184   359.6   8.239767 1.293102          ?        ? 
1 1 1   13   31   17 o 28.81755 2.139248   27.70274    77.6   8.750995 1.232958          ?        ? 
1 1 1   13   32    0 f 39.83232 2.473326   29.88089   360.0   16.08860 1.954689   16.08860 1.954689 
1 1 1   13   32    1 o 32.19155 2.195282   22.36045     6.3   10.40496 1.413391          ?        ? 
1 1 1   13   32    2 o 56.23192 1.283491   39.33366   302.0   31.66597 1.443463          ?        ? 
1 1 1   13   32    3 o 28.12219 2.031743   18.34096   148.9   7.939046 1.142741          ?        ? 
1 1 1   13   32    4 f 81.10452 1.112348   109.1358   192.4   65.85799 1.804329          ?        ? 
1 1 1   13   32    5 o 28.06537 1.982282   29.95304    94.3   7.908974 1.112669          ?        ? 
1 1 1   13   32    6 o 23.45067 2.244126   25.62748    13.1   5.533275 1.052525          ?        ? 
1 1 1   13   32    7 o 54.16995 1.304589   41.57170    84.1   29.41056 1.413391          ?        ? 
1 1 1   13   32    8 o 68.78873 1.202209   66.28434   319.7   47.42377 1.653968          ?        ? 
1 1 1   13   32    9 o 11.40646 3.755614   13.70583   358.1   1.293102 0.9923807          ?        ? 
1 1 1   13   32   10 o 25.40367 2.130789   27.07182   119.6   6.525656 1.082597          ?        ? 
1 1 1   13   32   11 o 40.39435 1.451705   33.93795    54.9   16.41939 1.172814          ?        ? 
1 1 1   13   32   12 o 31.26263 1.827648   21.14502    13.0   9.893736 1.142741          ?        ? 
1 1 1   13   32   13 o 28.00305 1.986693   16.08114   106.2   7.999191 1.112669          ?        ? 
1 1 1   13   32   14 o 14.22072 3.827249   14.22499   253.0   2.285483 1.112669          ?        ? 
1 1 1   13   32   15 o 33.01390 2.003966   30.37446   163.0   11.21691 1.323174          ?        ? 
1 1 1   13   32   16 o 19.65215 3.213465   18.79687   100.6   4.240172 1.263030          ?        ? 
1 1 1   13   32   17 o 8.222205 3.588730   7.939881   339.7  0.1503607 1.112669          ?        ? 
1 1 1   13   33    0 o 43.68454 2.390001   36.01595   180.0   19.30632 2.074978   19.30632 2.074978 
1 1 1   13   33    1 o 62.24899 1.400974   42.24963   140.6   38.82314 1.744184          ?        ? 
1 1 1   13   33    2 o 114.3457 1.196620   120.3748    94.7   130.9341 2.736565          ?        ? 
1 1 1   13   33    3 o 99.99828 1.157797   86.50749   119.5   100.1402 2.315555          ?        ? 
1 1 1   13   33    4 o 9.271344 3.785800   26.39747   163.0  0.3307936 1.112669          ?        ? 
1 1 1   13   33    5 o 12.71995 3.892362   26.53331   150.0   1.653968 1.082597          ?        ? 
1 1 1   13   33    6 o 43.49304 1.451991   44.82838   296.8   18.97552 1.263030          ?        ? 
1 1 1   13   33    7 o 51.13799 1.323132   41.05133   214.6   26.22291 1.353247          ?        ? 
1 1 1   13   33    8 o 31.05056 1.840130   24.07278   188.6   9.713303 1.142741          ?        ? 
1 1 1   13   33    9 o 72.08479 1.209815   67.45715    19.9   52.14510 1.744184          ?        ? 
1 1 1   13   33   10 o 46.69762 1.352349   31.05321   268.9   21.92259 1.263030          ?        ? 
1 1 1   13   33   11 o 46.77164 1.318061   42.05284   289.2   22.01281 1.232958          ?        ? 
1 1 1   13   33   12 o 20.84350 2.596966   12.27042    52.2   4.480750 1.082597          ?        ? 
1 1 1   13   33   13 o 42.39043 1.489758   40.41394   342.9   18.19365 1.263030          ?        ? 
1 1 1   13   33   14 o 26.55268 2.378347   22.26274    42.9   7.307531 1.263030          ?        ? 
1 1 1   13   33   15 o 8.361484 3.723244   9.224657     3.6 -0.1804329 1.263030          ?        ? 
1 1 1   13   33   16 f 22.07392 3.065260   27.38518   248.3   5.412986 1.353247          ?        ? 
1 1 1   13   34    0 o 74.42952 1.922007   72.96656     0.0   55.63347 2.856854   55.63347 2.856854 
1 1 1   13   34    1 o 10.31509 4.248526   6.500594   320.9  0.3608657 1.413391          ?        ? 
1 1 1   13   34    2 o 40.20321 1.533407   45.53327    53.3   16.20889 1.232958          ?        ? 
1 1 1   13   34    3 o 50.82226 1.420109   61.24250   247.0   25.89212 1.443463          ?        ? 
1 1 1   13   34    4 o 23.48913 2.432490   14.67205   172.5   5.563347 1.142741          ?        ? 
1 1 1   13   34    5 o 71.04945 1.142793   70.58596   146.3   50.58134 1.623896          ?        ? 
1 1 1   13   34    6 o 8.517298 3.596518   6.545424   228.1       0.09 1.052525          ?        ? 
1 1 1   13   34    7 o 46.88743 1.346875   41.06141    60.7   22.07295 1.263030          ?        ? 
1 1 1   13   34    8 o 35.53612 1.734795   32.65219     5.6   12.72052 1.232958          ?        ? 
1 1 1   13   34    9 o 31.49549 1.814135   27.14206   171.9   10.01402 1.142741          ?        ? 
1 1 1   13   34   10 o 8.303227 3.554509   13.19404   163.6       0.03 1.052525          ?        ? 
1 1 1   13   34   11 o 35.15590 1.710788   40.38226   202.2   12.51001 1.202886          ?        ? 
1 1 1   13   34   12 o 8.757676 3.641371   4.417123    41.9  0.3007214 1.052525          ?        ? 
1 1 1   13   34   13 o 29.37417 1.996335   22.41386     3.0   8.841210 1.172814          ?        ? 
1 1 1   13   34   14 o 26.12803 2.589645   18.43998   204.6   7.187243 1.353247          ?        ? 
1 1 1   13   34   15 o 38.98332 1.812815   32.52921   190.7   15.69766 1.413391          ?        ? 
1 1 1   13   34   16 o 32.71326 1.930455   31.84786   189.1   11.21691 1.263030          ?        ? 
1 1 1   13   35    0 f 99.41315 1.755704   101.9566     0.0   99.14787 3.488369   99.14787 3.488369 
1 1 1   13   35    1 f 53.94152 1.533112   63.12641   130.1   29.20005 1.653968          ?        ? 
1 1 1   13   35    2 o 83.97494 1.181758   72.57658    93.4   70.66954 1.984761          ?        ? 
1 1 1   13   35    3 o 23.86196 2.394484   34.50284    59.9   5.743780 1.142741          ?        ? 
1 1 1   13   35    4 o 53.90986 1.255101   40.69801   317.2   29.13991 1.353247          ?        ? 
1 1 1   13   35    5 o 68.03682 1.193395   67.88236   328.3   46.43139 1.623896          ?        ? 
1 1 1   13   35    6 o 50.16650 1.288811   63.68699   215.8   25.26060 1.293102          ?        ? 
1 1 1   13   35    7 o 15.94800 3.315684   25.02422   349.2   2.706493 1.022453          ?        ? 
1 1 1   13   35    8 o 17.50493 3.212196   14.73767   351.0   3.247792 1.082597          ?        ? 
1 1 1   13   35    9 o 18.90208 2.784152   16.05558   324.7   3.668802 1.052525          ?        ? 
1 1 1   13   35   10 o 19.84308 2.803672   17.78677    40.1   4.059740 1.112669          ?        ? 
1 1 1   13   35   11 o 12.20941 3.976718   6.677582   204.0   1.593824 1.112669          ?        ? 
1 1 1   13   35   12 o 26.64352 2.313804   32.97456   196.3   7.337603 1.232958          ?        ? 
1 1 1   13   35   13 o 18.91412 3.100366   23.73763   138.5   3.819162 1.172814          ?        ? 
1 1 1   13   35   14 o 17.35278 3.745801   18.96501   123.8   3.488369 1.263030          ?        ? 
1 1 1   13   35   15 o 40.79082 1.806209   43.15421    87.1   17.29148 1.473535          ?        ? 
1 1 1   13   36    0 o 15.55509 6.089313   21.86302   180.0   3.398152 1.804329   3.398152 1.804329 
1 1 1   13   36    1 o 79.03526 1.407814   72.40466   350.4   62.70042 2.225339          ?        ? 
1 1 1   13   36    2 o 44.00266 1.537687   38.53885   270.4   19.45668 1.353247          ?        ? 
1 1 1   13   36    3 o 99.51466 1.223862   97.61169   169.8   99.35837 2.435844          ?        ? 
1 1 1   13   36    4 o 45.14558 1.465453   34.37917   127.3   20.47913 1.323174          ?        ? 
1 1 1   13   36    5 o 12.73387 3.956152   17.33555   135.2   1.684040 1.112669          ?        ? 
1 1 1   13   36    6 o 37.50216 1.603755   41.82819   187.0   14.16398 1.202886          ?        ? 
1 1 1   13   36    7 o 47.52431 1.328825   41.31366   329.1   22.70447 1.263030          ?        ? 
1 1 1   13   36    8 o 47.32047 1.429875   45.26025   147.5   22.55411 1.353247          ?        ? 
1 1 1   13   36    9 o 6.644557 3.192462   18.66120    44.7  -1.684040 1.232958          ?        ? 
1 1 1   13   36   10 o 8.929383 3.757878   12.29793    17.6  0.2405772 1.142741          ?        ? 
1 1 1   13   36   11 o 28.68063 2.097035   43.29793   105.5   8.450273 1.202886          ?        ? 
1 1 1   13   36   12 o 36.14516 1.622366   28.39103   301.2   13.29189 1.172814          ?        ? 
1 1 1   13   36   13 o 8.764712 3.726301   8.147272   121.4  0.2706493 1.142741          ?        ? 
1 1 1   13   36   14 o 9.494895 4.046418   15.71338   313.6  0.4811543 1.353247          ?        ? 
1 1 1   13   37    0 o 24.12335 4.313148   30.19630   180.0   6.405366 1.894545   6.405366 1.894545 
1 1 1   13   37    1 o 37.20168 1.899633   35.78523   248.4   13.95348 1.413391          ?        ? 
1 1 1   13   37    2 o 18.55337 3.079607   10.98291    88.4   3.518441 1.142741          ?        ? 
1 1 1   13   37    3 o 32.63491 1.796870   38.99886     5.4   10.73576 1.172814          ?        ? 
1 1 1   13   37    4 o 31.06296 1.887801   20.22887   271.9   9.743376 1.172814          ?        ? 
1 1 1   13   37    5 o 61.89105 1.190427   64.65383   135.8   38.46227 1.473535          ?        ? 
1 1 1   13   37    6 o 53.44163 1.322369   40.20600   276.3   28.71890 1.413391          ?        ? 
1 1 1   13   37    7 f 27.50699 2.186509   23.53051   191.1   7.698469 1.202886          ?        ? 
1 1 1   13   37    8 o 10.17264 3.937398   19.08878   302.4  0.7818757 1.142741          ?        ? 
1 1 1   13   37    9 o 19.30874 2.803386   11.70179    96.4   3.879307 1.082597          ?        ? 
1 1 1   13   37   10 o 13.85149 3.938014   20.21231    62.3   2.165194 1.142741          ?        ? 
1 1 1   13   37   11 o 41.88919 1.507585   38.58823   184.4   17.80271 1.263030          ?        ? 
1 1 1   13   37   12 o 22.54363 2.667906   34.21827   311.4   5.382914 1.202886          ?        ? 
1 1 1   13   37   13 o 22.83809 2.567671   21.74917   215.3   5.563347 1.172814          ?        ? 
1 1 1   13   37   14 o 34.29571 2.104437   30.60424   195.7   12.41980 1.443463          ?        ? 
1 1 1   13   38    0 o 14.47445 6.667397   24.18019   180.0   3.217719 2.105050   3.217719 2.105050 
1 1 1   13   38    1 o 36.41091 1.817003   37.59806   218.9   13.38210 1.323174          ?        ? 
1 1 1   13   38    2 o 25.39966 2.367917   30.05693    25.0   6.555727 1.202886          ?        ? 
1 1 1   13   38    3 f 42.92412 1.541295   35.97758   249.3   18.55451 1.323174          ?        ? 
1 1 1   13   38    4 o 70.03484 1.159349   71.90914   341.2   49.25817 1.623896          ?        ? 
1 1 1   13   38    5 o 19.08742 2.993442   29.98189   282.8   3.759018 1.142741          ?        ? 
1 1 1   13   38    6 o 12.28632 4.030100   15.44580   352.2   1.563751 1.142741          ?        ? 
1 1 1   13   38    7 o 10.65965 3.984717   14.62968   282.8  0.9923807 1.142741          ?        ? 
1 1 1   13   38    8 o 29.36641 2.048064   31.24937   323.7   8.811138 1.202886          ?        ? 
1 1 1   13   38    9 o 12.50885 4.082783   9.282788   114.6   1.714112 1.172814          ?        ? 
1 1 1   13   38   10 o 11.05190 4.005613   10.82460   341.5   1.202886 1.142741          ?        ? 
1 1 1   13   38   11 o 9.351480 3.830577   9.710161   222.4  0.5412986 1.142741          ?        ? 
1 1 1   13   38   12 o 42.47401 1.522228   35.06295    76.6   18.43423 1.293102          ?        ? 
1 1 1   13   38   13 o 30.04315 2.152075   22.57000   103.5   9.532870 1.293102          ?        ? 
1 1 1   13   39    0 o 38.29866 2.817911   32.48330   180.0   15.09622 2.135122   15.09622 2.135122 
1 1 1   13   39    1 o 30.41915 2.026615   24.99110    69.3   9.382509 1.232958          ?        ? 
1 1 1   13   39    2 o 11.75188 4.077431   10.18935   109.3   1.353247 1.172814          ?        ? 
1 1 1   13   39    3 f 42.74828 1.547635   47.99932   232.8   18.43423 1.323174          ?        ? 
1 1 1   13   39    4 o 23.55658 2.553185   24.85442   302.1   5.683635 1.202886          ?        ? 
1 1 1   13   39    5 o 14.98316 3.724464   19.13487   189.4   2.465916 1.112669          ?        ? 
1 1 1   13   39    6 o 23.19618 2.592853   13.95934   263.0   5.563347 1.202886          ?        ? 
1 1 1   13   39    7 o 15.97496 3.654292   19.47552   278.6   2.826782 1.142741          ?        ? 
1 1 1   13   39    8 o 33.42164 1.799561   31.99661    69.4   11.39734 1.202886          ?        ? 
1 1 1   13   39    9 o 9.811796 3.962257   16.00062   281.7  0.6315150 1.202886          ?        ? 
1 1 1   13   39   10 o 14.10561 3.982857   13.51918   309.5   2.315555 1.172814          ?        ? 
1 1 1   13   39   11 o 30.55108 2.017863   29.52678    20.7   9.683230 1.232958          ?        ? 
1 1 1   13   39   12 o 15.31687 3.986742   5.524839   348.1   2.886926 1.232958          ?        ? 
1 1 1   13   40    0 o 64.42050 2.270195   62.50167     0.0   42.07093 2.916998   42.07093 2.916998 
1 1 1   13   40    1 o 20.75217 2.898216   19.79825    58.4   4.450677 1.202886          ?        ? 
1 1 1   13   40    2 o 19.93544 2.941530   19.26915   263.6   4.119884 1.172814          ?        ? 
1 1 1   13   40    3 o 19.85287 3.105238   15.11035    10.8   4.119884 1.232958          ?        ? 
1 1 1   13   40    4 f 23.21329 2.526169   24.74859   338.4   5.563347 1.172814          ?        ? 
1 1 1   13   40    5 o 45.89274 1.539885   40.99135   346.5   21.32115 1.413391          ?        ? 
1 1 1   13   40    6 o 37.62918 1.718218   33.88290   297.9   14.40456 1.293102          ?        ? 
1 1 1   13   40    7 o 26.42205 2.333199   28.57545   308.9   7.217315 1.232958          ?        ? 
1 1 1   13   40    8 o 10.93251 4.162943   2.914424     6.7   1.082597 1.263030          ?        ? 
1 1 1   13   40    9 o 27.59282 2.288693   29.43138   223.0   7.939046 1.263030          ?        ? 
1 1 1   13   40   10 o 8.740807 3.772203   10.26960    37.5  0.1804329 1.202886          ?        ? 
1 1 1   13   40   11 o 20.64835 3.204068   17.92870   311.6   4.781471 1.323174          ?        ? 
1 1 1   13   41    0 o 60.62545 2.013803   50.83151   180.0   37.25939 2.435844   37.25939 2.435844 
1 1 1   13   41    1 o 28.76439 2.195475   28.00925     5.1   8.480345 1.263030          ?        ? 
1 1 1   13   41    2 o 46.43694 1.457080   38.87942   255.6   21.80231 1.353247          ?        ? 
1 1 1   13   41    3 o 23.23448 2.588579   17.74801   305.5   5.593419 1.202886          ?        ? 
1 1 1   13   41    4 o 7.031803 3.287301   17.81449   156.4 -0.9322364 1.142741          ?        ? 
1 1 1   13   41    5 f 17.92281 3.479926   27.71212    13.9   3.548513 1.202886          ?        ? 
1 1 1   13   41    6 o 47.18991 1.497556   43.58156    68.5   22.58418 1.413391          ?        ? 
1 1 1   13   41    7 o 8.017521 3.578439   10.30414    71.4 -0.2706493 1.172814          ?        ? 
1 1 1   13   41    8 o 30.17150 2.093085   25.88268   180.8   9.442654 1.263030          ?        ? 
1 1 1   13   41    9 o 20.42178 2.945105   18.11848   243.7   4.510822 1.202886          ?        ? 
1 1 1   13   41   10 o 24.86040 2.600727   18.33830   326.2   6.676016 1.293102          ?        ? 
1 1 1   13   42    0 o 40.60725 2.842228   32.12467     0.0   17.14112 2.285483   17.14112 2.285483 
1 1 1   13   42    1 o 33.05168 1.956182   32.11393   197.7   11.18684 1.293102          ?        ? 
1 1 1   13   42    2 o 32.61486 1.936280   32.09076   184.2   10.88612 1.263030          ?        ? 
1 1 1   13   42    3 o 11.74765 4.077290   12.82329   177.4   1.443463 1.172814          ?        ? 
1 1 1   13   42    4 o 11.72772 4.076625   10.06920   133.8   1.443463 1.172814          ?        ? 
1 1 1   13   42    5 o 36.03836 1.835786   23.24800   153.4   13.29189 1.323174          ?        ? 
1 1 1   13   42    6 o 30.00303 2.205068   19.39441   171.6   9.352437 1.323174          ?        ? 
1 1 1   13   42    7 o 20.54129 3.074369   20.84590   117.0   4.570966 1.263030          ?        ? 
1 1 1   13   42    8 f 20.53824 3.001616   26.93753   142.1   4.601038 1.232958          ?        ? 
1 1 1   13   42    9 o 9.763236 4.017857   8.378963   188.7  0.7518036 1.263030          ?        ? 
1 1 1   13   43    0 o 9.203787 5.668408   18.03082     0.0   1.052525 1.984761   1.052525 1.984761 
1 1 1   13   43    1 o 32.74614 2.066269   33.52374   130.3   11.03648 1.353247          ?        ? 
1 1 1   13   43    2 o 25.98994 2.429844   20.91387    31.1   7.036882 1.263030          ?        ? 
1 1 1   13   43    3 o 17.53090 3.554708   9.971615    13.8   3.458297 1.202886          ?        ? 
1 1 1   13   43    4 o 42.55145 1.731475   32.35497    75.2   18.55451 1.473535          ?        ? 
1 1 1   13   43    5 o 27.02243 2.392646   21.04185   187.7   7.668397 1.293102          ?        ? 
1 1 1   13   43    6 o 18.38767 3.479264   18.56412   177.2   3.849235 1.232958          ?        ? 
1 1 1   13   43    7 f 10.08193 4.003537   3.221018   337.5  0.9322364 1.202886          ?        ? 
1 1 1   13   43    8 o 11.84188 4.173649   10.30290   166.5   1.684040 1.232958          ?        ? 
1 1 1   13   44    0 o 43.51917 2.716765   34.69190   180.0   19.75740 2.345627   19.75740 2.345627 
1 1 1   13   44    1 o 62.98386 1.313009   49.73224   285.6   40.26660 1.653968          ?        ? 
1 1 1   13   44    2 o 18.16310 3.688097   19.98024   340.8   3.789090 1.293102          ?        ? 
1 1 1   13   44    3 o 22.00165 2.870308   15.56411   246.3   5.202481 1.263030          ?        ? 
1 1 1   13   44    4 o 11.57892 4.071634   9.646903    32.3   1.503607 1.172814          ?        ? 
1 1 1   13   44    5 o 13.09352 4.235435   6.685291   177.5   2.105050 1.263030          ?        ? 
1 1 1   13   44    6 o 15.54894 4.099432   10.72247   285.3   3.007215 1.293102          ?        ? 
1 1 1   13   44    7 o 14.13755 4.113770   15.02048   173.9   2.526060 1.232958          ?        ? 
1 1 1   13   45    0 o 56.71216 2.181080   32.39742   180.0   33.13950 2.465916   33.13950 2.465916 
1 1 1   13   45    1 o 14.60851 4.200694   20.76299   275.7   2.646349 1.293102          ?        ? 
1 1 1   13   45    2 o 33.86899 1.997766   34.09218    44.7   11.99879 1.353247          ?        ? 
1 1 1   13   45    3 o 12.12635 4.229042   12.85666    19.3   1.774257 1.263030          ?        ? 
1 1 1   13   45    4 o 13.74114 4.204105   10.56411   297.6   2.375700 1.263030          ?        ? 
1 1 1   13   45    5 o 7.900472 3.588428   11.63827   149.6 -0.2706493 1.232958          ?        ? 
1 1 1   13   46    0 o 6.917155 4.720431   6.270560     0.0 -0.3608657 1.924617 -0.3608657 1.924617 
1 1 1   13   46    1 o 16.99405 3.810670   19.62739     9.8   3.518441 1.263030          ?        ? 
1 1 1   13   46    2 o 8.586030 3.800757   4.598556   165.1       0.09 1.293102          ?        ? 
1 1 1   14    0    0 o 266.0365 3.471581   365.8373   180.0   708.1990 18.46430   708.1990 18.46430 
1 1 1   14    0    1 f 271.8074 2.412328   370.1180     0.0   739.0530 13.11145   739.0530 13.11145 
1 1 1   14    0    2 o 433.7362 3.682168   560.5569     0.0   1882.216 31.93662   1882.216 31.93662 
1 1 1   14    0    3 o 564.9026 4.600121   660.7464     0.0   3193.271 51.96467   3193.271 51.96467 
1 1 1   14    0    4 o 634.3809 5.917166   869.7351     0.0   4028.675 75.06007   4028.675 75.06007 
1 1 1   14    0    5 o 269.3244 2.389898   260.7814   180.0   725.6409 12.87088   725.6409 12.87088 
1 1 1   14    0    6 o 131.2430 1.363673   213.5438   180.0   172.3134 3.578585   172.3134 3.578585 
1 1 1   14    0    7 f 101.4801 1.141215   47.35265   180.0   103.0272 2.315555   103.0272 2.315555 
1 1 1   14    0    8 o 261.0968 2.672718   348.3270   180.0   682.1866 13.95348   682.1866 13.95348 
1 1 1   14    0    9 o 157.7542 1.821028   137.2962     0.0   249.0274 5.743780   249.0274 5.743780 
1 1 1   14    0   10 o 93.69684 1.139756   139.6761     0.0   87.84074 2.135122   87.84074 2.135122 
1 1 1   14    0   11 o 133.7841 1.360241   159.6755   180.0   179.0796 3.638730   179.0796 3.638730 
1 1 1   14    0   12 o 37.82825 1.035169   94.26276   180.0   14.34441 0.7818757   14.34441 0.7818757 
1 1 1   14    0   13 o 122.1957 1.341599   135.8845     0.0   149.4285 3.277864   149.4285 3.277864 
1 1 1   14    0   14 o 24.87141 1.771262   22.77412     0.0   6.285078 0.8720922   6.285078 0.8720922 
1 1 1   14    0   15 o 30.67625 1.378410   51.76538   180.0   9.472726 0.8420200   9.472726 0.8420200 
1 1 1   14    0   16 o 93.64449 1.349377   116.5552     0.0   87.81066 2.526060   87.81066 2.526060 
1 1 1   14    0   17 o 41.12526 1.651045   49.47427   180.0   17.02083 1.353247   17.02083 1.353247 
1 1 1   14    0   18 o 14.69037 3.918005   29.08152     0.0   2.586205 0.9923807   2.586205 0.9923807 
1 1 1   14    0   19 o 18.23899 3.495610   4.901124   180.0   3.698874 1.142741   3.698874 1.142741 
1 1 1   14    0   20 o 34.22779 1.946054   46.54512   180.0   11.90857 1.323174   11.90857 1.323174 
1 1 1   14    0   21 o 44.92463 1.577322   54.28897   180.0   20.38891 1.413391   20.38891 1.413391 
1 1 1   14    0   22 o 5.831338 3.830773   2.123566     0.0   0.000000 1.082597   0.000000 1.082597 
1 1 1   14    0   23 o 4.994293 3.401303   7.198034     0.0 -0.3307936 0.9923807 -0.3307936 0.9923807 
1 1 1   14    1    0 o 199.2599 1.977479   216.7890    -0.0   397.1929 7.878902   397.1929 7.878902 
1 1 1   14    1    1 o 314.9998 2.019131   312.2634   328.0   992.4109 12.72052          ?        ? 
1 1 1   14    1    2 o 58.42181 0.7463756   101.7440    55.7   34.13189 0.8720922          ?        ? 
1 1 1   14    1    3 o 169.6207 1.205576   121.5031   342.7   287.7303 4.089812          ?        ? 
1 1 1   14    1    4 o 203.0038 1.325816   244.8909   341.5   412.1387 5.382914          ?        ? 
1 1 1   14    1    5 o 121.0764 0.9189814   138.3195   278.5   146.6017 2.225339          ?        ? 
1 1 1   14    1    6 o 166.9654 1.161710   252.9263    65.2   278.7989 3.879307          ?        ? 
1 1 1   14    1    7 f 286.1914 1.870371   433.6030   310.3   819.3156 10.70568          ?        ? 
1 1 1   14    1    8 o 149.8569 1.264236   182.5095    30.3   224.6089 3.789090          ?        ? 
1 1 1   14    1    9 o 189.1219 1.319778   209.5826   295.0   357.7683 4.991976          ?        ? 
1 1 1   14    1   10 o 98.70171 0.8530957   208.2725   174.5   97.43375 1.684040          ?        ? 
1 1 1   14    1   11 o 77.11991 0.7213892   86.73013   174.6   59.48270 1.112669          ?        ? 
1 1 1   14    1   12 o 66.55003 0.7004027   91.36731    27.6   44.29627 0.9322364          ?        ? 
1 1 1   14    1   13 o 133.6242 0.9902209   194.2946   308.6   178.6285 2.646349          ?        ? 
1 1 1   14    1   14 o 48.14286 0.7808051   64.84539    87.5   23.18562 0.7518036          ?        ? 
1 1 1   14    1   15 o 86.51500 0.8168473   87.20988   308.0   74.87964 1.413391          ?        ? 
1 1 1   14    1   16 o 30.61255 1.227934   20.98951   309.4   9.382509 0.7518036          ?        ? 
1 1 1   14    1   17 o 26.77348 1.516329   36.81517    29.1   7.187243 0.8119479          ?        ? 
1 1 1   14    1   18 o 66.25787 0.9758103   70.02854    46.6   43.96547 1.293102          ?        ? 
1 1 1   14    1   19 o 27.62208 1.415310   21.80850    15.0   7.668397 0.7818757          ?        ? 
1 1 1   14    1   20 o 16.38574 2.294079   16.26393    52.5   2.736565 0.7518036          ?        ? 
1 1 1   14    1   21 o 32.92165 1.370169   37.84170   359.5   10.94626 0.9021643          ?        ? 
1 1 1   14    1   22 o 13.55867 3.518829   23.44379   261.7   2.074978 0.9623086          ?        ? 
1 1 1   14    1   23 o 20.67366 2.691031   13.25965   177.5   4.631110 1.112669          ?        ? 
1 1 1   14    2    0 o 424.7561 3.696316   434.1947   180.0   1805.080 31.39532   1805.080 31.39532 
1 1 1   14    2    1 o 380.1451 2.309925   547.8070   168.7   1445.418 17.56213          ?        ? 
1 1 1   14    2    2 o 231.9605 1.536274   205.7043   167.1   538.1110 7.127099          ?        ? 
1 1 1   14    2    3 f 264.0164 1.668672   285.2021   134.5   697.1324 8.811138          ?        ? 
1 1 1   14    2    4 o 91.87491 0.8019247   44.86981   288.0   84.41251 1.473535          ?        ? 
1 1 1   14    2    5 o 119.6146 0.9176416   122.6587   112.0   143.0833 2.195267          ?        ? 
1 1 1   14    2    6 f 235.0113 1.593107   333.1611   297.1   552.3953 7.487964          ?        ? 
1 1 1   14    2    7 o 357.0880 2.530659   360.1292   256.4   1275.871 18.07336          ?        ? 
1 1 1   14    2    8 f 181.1733 1.601760   179.2640   113.2   328.3277 5.803924          ?        ? 
1 1 1   14    2    9 o 119.2384 1.210569   110.2208   141.0   142.2112 2.886926          ?        ? 
1 1 1   14    2   10 o 52.13743 0.6344647   71.22444   117.6   27.18522 0.6615872          ?        ? 
1 1 1   14    2   11 o 3.514734 1.713521   1.973163   271.0 -0.7217315 0.3909379          ?        ? 
1 1 1   14    2   12 o 26.12360 0.9209188   48.92365   308.1   6.826377 0.4811543          ?        ? 
1 1 1   14    2   13 o 57.16801 0.6838403   86.23581   189.2   32.68842 0.7818757          ?        ? 
1 1 1   14    2   14 o 66.52121 0.7685165   81.14901   129.3   44.26620 1.022453          ?        ? 
1 1 1   14    2   15 o 27.35371 1.099381   57.21680    95.7   7.487964 0.6014429          ?        ? 
1 1 1   14    2   16 o 57.49533 0.9153135   40.07574   287.5   33.07936 1.052525          ?        ? 
1 1 1   14    2   17 o 48.59135 0.9592617   42.09031    87.8   23.63671 0.9322364          ?        ? 
1 1 1   14    2   18 o 35.49160 1.313320   23.01961   344.9   12.63030 0.9322364          ?        ? 
1 1 1   14    2   19 o 48.23399 1.091062   58.92299   261.3   23.33598 1.052525          ?        ? 
1 1 1   14    2   20 o 17.17909 2.275661   17.17899   332.9   3.007215 0.7818757          ?        ? 
1 1 1   14    2   21 o 15.40004 3.227901   20.21241   225.0   2.586205 0.9623086          ?        ? 
1 1 1   14    2   22 o 10.13255 3.623277   8.230091   258.4   1.022453 0.9322364          ?        ? 
1 1 1   14    2   23 f 17.78439 3.419312   17.90897   245.7   3.668802 1.172814          ?        ? 
1 1 1   14    3    0 o 183.9388 1.856035   83.48673     0.0   338.4620 6.826377   338.4620 6.826377 
1 1 1   14    3    1 o 79.33437 0.7770642   56.87218   191.4   62.94100 1.232958          ?        ? 
1 1 1   14    3    2 o 104.3347 0.8935053   90.90409   275.2   108.8612 1.864473          ?        ? 
1 1 1   14    3    3 o 255.0083 1.645070   257.3675   230.5   650.3702 8.390128          ?        ? 
1 1 1   14    3    4 o 138.9222 1.006574   190.0862   307.0   193.0030 2.796710          ?        ? 
1 1 1   14    3    5 f 278.8101 1.925281   363.4237   127.0   777.5153 10.73576          ?        ? 
1 1 1   14    3    6 o 174.1803 1.398461   176.5830   145.5   303.4279 4.871688          ?        ? 
1 1 1   14    3    7 o 319.9019 2.331306   364.8467   175.1   1023.896 14.91578          ?        ? 
1 1 1   14    3    8 o 51.64487 0.8443165   37.57802   326.8   26.67399 0.8720922          ?        ? 
1 1 1   14    3    9 o 8.492925 3.168325   55.34375    29.5  0.5412986 0.7217315          ?        ? 
1 1 1   14    3   10 o 103.3097 1.135241   143.4901    65.4   106.7561 2.345627          ?        ? 
1 1 1   14    3   11 o 30.43171 0.7411385   55.30954    40.5   9.262220 0.4510822          ?        ? 
1 1 1   14    3   12 o 88.31051 0.8513185   138.9048   281.5   78.00714 1.503607          ?        ? 
1 1 1   14    3   13 o 48.70481 0.7100524   75.44530   220.7   23.72692 0.6916593          ?        ? 
1 1 1   14    3   14 f 45.47729 0.7935076   63.41374   152.0   20.68964 0.7217315          ?        ? 
1 1 1   14    3   15 o 42.18164 0.9267964   57.69398    54.2   17.80271 0.7818757          ?        ? 
1 1 1   14    3   16 o 101.5219 0.9775037   113.7707   124.9   103.1475 1.984761          ?        ? 
1 1 1   14    3   17 o 108.6359 1.176468   128.0260   209.8   118.2136 2.556132          ?        ? 
1 1 1   14    3   18 o 61.45020 1.076623   66.36502   273.8   37.83076 1.323174          ?        ? 
1 1 1   14    3   19 o 23.02877 1.893484   21.49615    62.1   5.352841 0.8720922          ?        ? 
1 1 1   14    3   20 f 24.83932 1.937067   42.96371    70.7   6.255006 0.9623086          ?        ? 
1 1 1   14    3   21 o 32.71975 1.608394   37.96908   122.6   10.85604 1.052525          ?        ? 
1 1 1   14    3   22 o 37.84821 1.469910   36.38544   174.7   14.55492 1.112669          ?        ? 
1 1 1   14    3   23 o 12.05447 4.082787   19.83434   272.0   1.744184 1.172814          ?        ? 
1 1 1   14    4    0 o 629.3307 5.156706   665.7137    -0.0   3963.599 64.89569   3963.599 64.89569 
1 1 1   14    4    1 o 100.0233 0.8869214   38.45536   152.2   100.0500 1.774257          ?        ? 
1 1 1   14    4    2 o 488.1605 2.889181   475.5798   340.2   2383.879 28.20767          ?        ? 
1 1 1   14    4    3 o 166.1365 1.239910   229.4200   248.1   276.0322 4.119884          ?        ? 
1 1 1   14    4    4 o 127.8645 1.058345   98.16484   349.2   163.5023 2.706493          ?        ? 
1 1 1   14    4    5 o 526.8220 3.276517   620.8151     4.4   2777.163 34.52282          ?        ? 
1 1 1   14    4    6 o 159.6803 1.365372   204.5788   264.6   255.0118 4.360461          ?        ? 
1 1 1   14    4    7 o 77.41325 0.9905794   144.2920     5.9   59.93378 1.533679          ?        ? 
1 1 1   14    4    8 o 98.94552 1.078938   176.2145   349.4   97.91490 2.135122          ?        ? 
1 1 1   14    4    9 o 112.2627 1.245609   151.3659    10.0   126.0624 2.796710          ?        ? 
1 1 1   14    4   10 o 91.55336 1.100360   182.1208    96.5   83.84113 2.014834          ?        ? 
1 1 1   14    4   11 o 110.8760 1.342555   95.61273   263.7   122.9951 2.977142          ?        ? 
1 1 1   14    4   12 o 43.96899 0.7181368   77.97097   247.0   19.33639 0.6315150          ?        ? 
1 1 1   14    4   13 f 135.8565 1.095694   183.1133    40.0   184.6730 2.977142          ?        ? 
1 1 1   14    4   14 o 52.18832 0.7490909   57.22150   330.0   27.24536 0.7818757          ?        ? 
1 1 1   14    4   15 o 77.45040 0.9901043   75.85143   282.2   60.02400 1.533679          ?        ? 
1 1 1   14    4   16 o 72.14094 0.9796038   101.8820   124.9   52.08495 1.413391          ?        ? 
1 1 1   14    4   17 f 95.14787 0.9797765   104.7753    60.7   90.63744 1.864473          ?        ? 
1 1 1   14    4   18 o 27.55911 1.855018   25.39685    83.0   7.638325 1.022453          ?        ? 
1 1 1   14    4   19 o 81.96827 1.210689   103.7621    87.0   67.45182 1.984761          ?        ? 
1 1 1   14    4   20 o 16.56640 3.015971   16.50728    20.4   2.916998 0.9623086          ?        ? 
1 1 1   14    4   21 o 20.91339 2.372596   24.68170   194.9   4.510822 0.9923807          ?        ? 
1 1 1   14    4   22 o 9.560204 3.675663   6.817798    41.0  0.7818757 0.9923807          ?        ? 
1 1 1   14    4   23 o 20.09787 2.468871   19.22895   330.8   4.330389 0.9923807          ?        ? 
1 1 1   14    5    0 f 387.1458 3.414481   339.8801   180.0   1499.547 26.43342   1499.547 26.43342 
1 1 1   14    5    1 o 435.5129 2.813785   418.5369   291.5   1897.372 24.50880          ?        ? 
1 1 1   14    5    2 o 421.9196 2.736944   468.8161   245.8   1780.752 23.09541          ?        ? 
1 1 1   14    5    3 f 262.6024 1.820802   347.3795   166.7   689.7047 9.562942          ?        ? 
1 1 1   14    5    4 o 217.6462 1.533686   205.3577   265.4   473.7566 6.676016          ?        ? 
1 1 1   14    5    5 o 61.57857 0.8790373   139.5947    19.1   37.92097 1.082597          ?        ? 
1 1 1   14    5    6 o 190.1372 1.549971   203.2894    37.4   361.5875 5.894140          ?        ? 
1 1 1   14    5    7 o 393.2968 3.375785   419.3246     0.3   1548.565 26.55371          ?        ? 
1 1 1   14    5    8 o 180.6747 1.531281   238.9167   233.2   326.5234 5.533275          ?        ? 
1 1 1   14    5    9 o 72.94964 1.092414   106.5808     0.2   53.22770 1.593824          ?        ? 
1 1 1   14    5   10 o 117.3254 1.255939   141.5111   201.8   137.7003 2.947070          ?        ? 
1 1 1   14    5   11 o 145.3701 1.530810   179.9377   213.0   211.4673 4.450677          ?        ? 
1 1 1   14    5   12 o 67.26681 0.7599981   81.83506   186.8   45.25858 1.022453          ?        ? 
1 1 1   14    5   13 o 98.36949 0.8865474   132.3147   119.5   96.80223 1.744184          ?        ? 
1 1 1   14    5   14 o 26.95594 1.617625   49.41475   171.1   7.277459 0.8720922          ?        ? 
1 1 1   14    5   15 o 73.36736 0.9427344   78.11206   204.8   53.85921 1.383319          ?        ? 
1 1 1   14    5   16 o 118.3234 1.156392   138.9467     1.5   140.1663 2.736565          ?        ? 
1 1 1   14    5   17 o 72.82538 1.052984   104.0822    51.2   53.10741 1.533679          ?        ? 
1 1 1   14    5   18 o 86.62622 1.128232   106.9684    91.1   75.21043 1.954689          ?        ? 
1 1 1   14    5   19 o 11.17920 3.755613   22.52702   198.6   1.232958 0.9923807          ?        ? 
1 1 1   14    5   20 o 62.31569 1.182315   69.15702   204.1   39.03365 1.473535          ?        ? 
1 1 1   14    5   21 o 17.21461 2.795034   10.21633   157.8   3.097431 0.9623086          ?        ? 
1 1 1   14    5   22 o 28.14027 1.923573   32.03572   347.3   8.149551 1.082597          ?        ? 
1 1 1   14    5   23 o 12.77607 4.186162   15.00247    39.0   2.014834 1.232958          ?        ? 
1 1 1   14    6    0 o 293.2198 3.180148   282.7759   180.0   860.2738 18.64473   860.2738 18.64473 
1 1 1   14    6    1 o 227.2545 1.786429   218.6396   167.8   516.5192 8.119479          ?        ? 
1 1 1   14    6    2 o 154.6632 1.254114   197.0354    30.6   239.2239 3.879307          ?        ? 
1 1 1   14    6    3 o 393.2681 2.584595   465.9105   179.1   1547.092 20.32877          ?        ? 
1 1 1   14    6    4 o 59.08678 0.8143180   57.53127   263.7   34.91376 0.9623086          ?        ? 
1 1 1   14    6    5 o 215.0820 1.405162   234.0121   123.6   462.6599 6.044501          ?        ? 
1 1 1   14    6    6 o 333.4822 2.407703   376.4515    40.2   1112.639 16.05853          ?        ? 
1 1 1   14    6    7 f 201.1625 1.621986   273.2887    83.5   404.7711 6.525656          ?        ? 
1 1 1   14    6    8 o 172.8860 1.469810   95.19907   253.3   298.9773 5.082192          ?        ? 
1 1 1   14    6    9 o 70.75385 0.9988083   91.12192   313.4   50.07012 1.413391          ?        ? 
1 1 1   14    6   10 o 175.3494 1.749284   241.7731   128.4   307.6982 6.134717          ?        ? 
1 1 1   14    6   11 o 182.4404 1.854368   216.1553   201.7   333.1994 6.766232          ?        ? 
1 1 1   14    6   12 f 121.3243 1.041036   141.5721   352.1   147.2633 2.526060          ?        ? 
1 1 1   14    6   13 o 66.24512 0.9986958   83.29797   137.8   43.90533 1.323174          ?        ? 
1 1 1   14    6   14 o 61.34031 1.054040   72.15855   243.1   37.65033 1.293102          ?        ? 
1 1 1   14    6   15 o 20.54724 2.561233   35.23856   158.2   4.240172 1.052525          ?        ? 
1 1 1   14    6   16 o 39.58878 1.329322   39.74268   262.4   15.69766 1.052525          ?        ? 
1 1 1   14    6   17 o 44.37334 1.253759   45.21814   195.8   19.72733 1.112669          ?        ? 
1 1 1   14    6   18 o 26.26562 1.889125   29.64461   184.9   6.946666 0.9923807          ?        ? 
1 1 1   14    6   19 o 7.384455 3.293899   4.697858   121.4 -0.3608657 0.9923807          ?        ? 
1 1 1   14    6   20 o 23.35126 2.318070   14.99988    62.3   5.563347 1.082597          ?        ? 
1 1 1   14    6   21 o 41.50038 1.449247   46.23077   269.2   17.44184 1.202886          ?        ? 
1 1 1   14    6   22 o 17.86337 3.405046   18.00701   137.9   3.578585 1.172814          ?        ? 
1 1 1   14    6   23 o 6.690079 3.154746   7.995430    82.6 -0.9322364 1.112669          ?        ? 
1 1 1   14    7    0 o 260.4371 2.835492   192.2285   180.0   678.6381 14.76542   678.6381 14.76542 
1 1 1   14    7    1 o 434.3221 3.108844   503.2613   206.7   1887.177 27.00479          ?        ? 
1 1 1   14    7    2 o 290.4664 2.122376   384.3099   161.2   843.8845 12.32958          ?        ? 
1 1 1   14    7    3 o 386.3857 2.712353   424.9160    83.9   1493.503 20.96028          ?        ? 
1 1 1   14    7    4 o 196.8002 1.573896   230.9220    32.0   387.3593 6.194862          ?        ? 
1 1 1   14    7    5 o 353.9750 2.323534   323.4092   308.9   1253.437 16.44946          ?        ? 
1 1 1   14    7    6 o 80.74004 1.080124   131.7922   281.1   65.19641 1.744184          ?        ? 
1 1 1   14    7    7 o 194.8804 1.728280   275.6964   153.8   379.9014 6.736160          ?        ? 
1 1 1   14    7    8 o 51.14556 1.058349   58.87366   322.4   26.16277 1.082597          ?        ? 
1 1 1   14    7    9 o 18.50731 2.193587   34.99467   257.9   3.428224 0.8119479          ?        ? 
1 1 1   14    7   10 o 81.47058 1.218085   102.0123    48.2   66.39930 1.984761          ?        ? 
1 1 1   14    7   11 o 41.64120 1.444346   55.47066   119.5   17.35163 1.202886          ?        ? 
1 1 1   14    7   12 o 20.28894 1.408084   14.17786   184.3   4.119884 0.5713707          ?        ? 
1 1 1   14    7   13 o 50.09777 1.020457   60.07075   116.0   25.11024 1.022453          ?        ? 
1 1 1   14    7   14 o 35.56440 1.310632   30.19158    52.6   12.66037 0.9322364          ?        ? 
1 1 1   14    7   15 o 50.59037 1.278012   70.37740   114.8   25.62147 1.293102          ?        ? 
1 1 1   14    7   16 o 24.76731 2.306955   29.01108    30.1   6.164790 1.142741          ?        ? 
1 1 1   14    7   17 o 20.66151 2.474294   15.78160   319.4   4.300317 1.022453          ?        ? 
1 1 1   14    7   18 o 87.10594 1.139280   93.02304   252.7   76.08253 1.984761          ?        ? 
1 1 1   14    7   19 o 57.08506 1.185290   65.13645   242.7   32.71849 1.353247          ?        ? 
1 1 1   14    7   20 o 62.89668 1.027958   74.13486   144.6   39.72530 1.293102          ?        ? 
1 1 1   14    7   21 o 21.99714 2.460768   23.35780   306.1   5.022048 1.082597          ?        ? 
1 1 1   14    7   22 f 26.90903 2.346851   30.99114   166.0   7.578181 1.263030          ?        ? 
1 1 1   14    7   23 o 26.90738 2.346996   31.49302   152.3   7.728541 1.263030          ?        ? 
1 1 1   14    8    0 o 129.5543 1.799708   34.62134   180.0   167.9529 4.661182   167.9529 4.661182 
1 1 1   14    8    1 o 304.1596 2.239397   401.6120    27.1   925.3500 13.62268          ?        ? 
1 1 1   14    8    2 o 252.1832 1.955654   330.8215    69.3   636.0860 9.863664          ?        ? 
1 1 1   14    8    3 o 60.98969 0.9368318   61.12928   200.0   37.19924 1.142741          ?        ? 
1 1 1   14    8    4 o 262.3657 1.845369   316.7804   134.9   688.5018 9.683230          ?        ? 
1 1 1   14    8    5 o 196.3944 1.416371   259.9549   310.1   385.7655 5.563347          ?        ? 
1 1 1   14    8    6 o 196.6152 1.575377   213.6916   228.2   386.6677 6.194862          ?        ? 
1 1 1   14    8    7 o 187.8025 1.689334   227.3481   273.3   352.8064 6.345222          ?        ? 
1 1 1   14    8    8 o 32.43744 1.436976   28.94834   353.9   10.52525 0.9322364          ?        ? 
1 1 1   14    8    9 o 136.6094 1.386834   200.4003   229.2   186.6879 3.789090          ?        ? 
1 1 1   14    8   10 o 48.07795 1.344798   77.49045    94.6   23.12548 1.293102          ?        ? 
1 1 1   14    8   11 o 138.4852 1.791492   170.6157   263.0   191.9806 4.961904          ?        ? 
1 1 1   14    8   12 o 105.6148 1.081990   130.3204   156.6   111.5977 2.285483          ?        ? 
1 1 1   14    8   13 o 117.5242 1.189844   145.3241   256.4   138.2116 2.796710          ?        ? 
1 1 1   14    8   14 o 111.2227 1.392446   123.7332    96.3   123.8371 3.097431          ?        ? 
1 1 1   14    8   15 o 85.67498 1.140759   98.76934   144.6   73.46625 1.954689          ?        ? 
1 1 1   14    8   16 o 96.81068 1.211451   125.0026   272.3   93.85516 2.345627          ?        ? 
1 1 1   14    8   17 o 57.07516 1.132807   64.71291    66.8   32.62828 1.293102          ?        ? 
1 1 1   14    8   18 o 63.32166 1.116040   76.57501   133.7   40.20646 1.413391          ?        ? 
1 1 1   14    8   19 o 26.59229 2.035548   33.82168     6.7   7.157170 1.082597          ?        ? 
1 1 1   14    8   20 o 11.11135 3.811709   25.05673   300.7   1.232958 1.022453          ?        ? 
1 1 1   14    8   21 o 26.08067 2.190782   27.89155   353.9   7.006810 1.142741          ?        ? 
1 1 1   14    8   22 o 35.70995 1.726350   34.72081    25.4   13.08138 1.232958          ?        ? 
1 1 1   14    8   23 o 34.22755 1.888979   38.30396   334.1   12.23936 1.293102          ?        ? 
1 1 1   14    9    0 o 117.9608 1.606748   47.36699     0.0   139.2340 3.789090   139.2340 3.789090 
1 1 1   14    9    1 o 126.3136 1.178473   157.6102   269.6   159.5628 2.977142          ?        ? 
1 1 1   14    9    2 f 328.7749 2.401016   248.9716    54.1   1081.274 15.78788          ?        ? 
1 1 1   14    9    3 o 405.3448 2.945305   445.3409    59.2   1643.894 23.87728          ?        ? 
1 1 1   14    9    4 o 147.2408 1.225427   184.1014   100.7   216.8202 3.608657          ?        ? 
1 1 1   14    9    5 o 131.6508 1.062170   122.7988   202.1   173.3358 2.796710          ?        ? 
1 1 1   14    9    6 o 223.7824 1.585698   204.5208   286.6   500.9117 7.097026          ?        ? 
1 1 1   14    9    7 o 66.43761 1.108962   73.80232   354.2   44.14591 1.473535          ?        ? 
1 1 1   14    9    8 o 180.9374 1.703570   219.5449    73.6   327.5458 6.164790          ?        ? 
1 1 1   14    9    9 o 189.5585 1.753006   245.3674    60.5   359.5425 6.645944          ?        ? 
1 1 1   14    9   10 f 152.8777 1.760530   178.8725   138.0   233.9011 5.382914          ?        ? 
1 1 1   14    9   11 o 118.9286 1.744726   122.2560   178.3   141.5797 4.149956          ?        ? 
1 1 1   14    9   12 o 48.57715 0.9904951   62.28624   224.3   23.60663 0.9623086          ?        ? 
1 1 1   14    9   13 o 71.58659 1.008194   70.08294    36.5   51.27301 1.443463          ?        ? 
1 1 1   14    9   14 o 12.23564 3.582475   43.18663   173.5   1.533679 0.9322364          ?        ? 
1 1 1   14    9   15 o 26.38074 1.880882   45.71106   182.1   6.976738 0.9923807          ?        ? 
1 1 1   14    9   16 o 98.98923 1.199979   106.0803   287.7   98.12540 2.375700          ?        ? 
1 1 1   14    9   17 o 73.63315 1.266055   65.67805   356.9   54.34037 1.864473          ?        ? 
1 1 1   14    9   18 o 32.19641 1.727940   44.63177   121.4   10.43503 1.112669          ?        ? 
1 1 1   14    9   19 o 44.66392 1.346597   57.80891   194.5   20.05812 1.202886          ?        ? 
1 1 1   14    9   20 o 28.39733 1.959109   33.37442   260.2   8.209695 1.112669          ?        ? 
1 1 1   14    9   21 o 22.47206 2.208033   16.45651   266.5   5.202481 0.9923807          ?        ? 
1 1 1   14    9   22 o 21.68761 2.634549   23.56268    14.8   4.991976 1.142741          ?        ? 
1 1 1   14    9   23 o 12.58786 4.186157   14.59089    31.2   1.984761 1.232958          ?        ? 
1 1 1   14   10    0 o 65.30446 1.336673   152.5910     0.0   42.70245 1.744184   42.70245 1.744184 
1 1 1   14   10    1 o 226.4326 1.872598   276.5354    18.1   512.8203 8.480345          ?        ? 
1 1 1   14   10    2 o 160.9381 1.410758   220.6846   139.5   259.0415 4.540894          ?        ? 
1 1 1   14   10    3 o 138.4968 1.161658   182.1751    55.5   191.8302 3.217719          ?        ? 
1 1 1   14   10    4 o 116.0646 1.140033   141.4534   290.3   134.7232 2.646349          ?        ? 
1 1 1   14   10    5 o 99.14417 1.046445   100.0771   199.4   98.30584 2.074978          ?        ? 
1 1 1   14   10    6 o 108.2482 1.083448   104.1919    67.9   117.1912 2.345627          ?        ? 
1 1 1   14   10    7 o 170.6545 1.427354   206.0917   155.9   291.3089 4.871688          ?        ? 
1 1 1   14   10    8 o 105.6672 1.266439   115.5299     4.0   111.6879 2.676421          ?        ? 
1 1 1   14   10    9 o 166.6182 1.597296   161.1026   354.4   277.7764 5.322770          ?        ? 
1 1 1   14   10   10 o 84.79823 1.117090   96.25004   337.7   71.93257 1.894545          ?        ? 
1 1 1   14   10   11 o 111.3180 1.256180   126.1481   245.9   123.9874 2.796710          ?        ? 
1 1 1   14   10   12 o 71.71647 0.9644359   95.50358   307.2   51.45344 1.383319          ?        ? 
1 1 1   14   10   13 o 116.3032 1.241121   127.6737   261.0   135.3848 2.886926          ?        ? 
1 1 1   14   10   14 o 22.04236 2.114647   41.17978   185.0   4.871688 0.9322364          ?        ? 
1 1 1   14   10   15 o 75.29354 1.138286   100.8095   212.2   56.74614 1.714112          ?        ? 
1 1 1   14   10   16 o 42.50528 1.414984   47.56749   349.7   18.10343 1.202886          ?        ? 
1 1 1   14   10   17 o 11.96408 3.922611   21.29730   161.4   1.413391 1.082597          ?        ? 
1 1 1   14   10   18 o 29.91301 1.910108   36.01265    97.3   9.021644 1.142741          ?        ? 
1 1 1   14   10   19 o 24.18666 2.362338   17.25800   259.3   5.954284 1.142741          ?        ? 
1 1 1   14   10   20 o 49.51695 1.275351   56.88353     1.5   24.71930 1.263030          ?        ? 
1 1 1   14   10   21 o 22.99726 2.549899   30.34554   319.1   5.503202 1.172814          ?        ? 
1 1 1   14   10   22 o 9.668684 3.846998   8.889457    81.1  0.7518036 1.112669          ?        ? 
1 1 1   14   11    0 o 86.45213 1.845463   120.2082   180.0   74.84956 3.187647   74.84956 3.187647 
1 1 1   14   11    1 o 65.68848 1.190278   103.8009   181.5   43.15353 1.563751          ?        ? 
1 1 1   14   11    2 o 211.4408 1.870258   187.8029   253.2   447.1728 7.908974          ?        ? 
1 1 1   14   11    3 o 414.9316 2.949730   567.4498   237.9   1722.773 24.47873          ?        ? 
1 1 1   14   11    4 o 49.04602 1.103655   48.03476    42.3   24.05772 1.082597          ?        ? 
1 1 1   14   11    5 o 137.4018 1.269404   200.8272    79.0   188.8230 3.488369          ?        ? 
1 1 1   14   11    6 o 69.51318 0.9733740   96.96069   139.3   48.32594 1.353247          ?        ? 
1 1 1   14   11    7 o 144.7057 1.298849   148.8305   114.0   209.4525 3.759018          ?        ? 
1 1 1   14   11    8 o 25.24605 1.191162   15.61730   232.5   6.375295 0.6014429          ?        ? 
1 1 1   14   11    9 f 89.84200 1.171529   64.32401   214.5   80.74371 2.105050          ?        ? 
1 1 1   14   11   10 o 124.8545 1.168159   145.9897   168.0   155.9541 2.916998          ?        ? 
1 1 1   14   11   11 o 84.74641 0.8693790   106.9680   305.8   71.84235 1.473535          ?        ? 
1 1 1   14   11   12 o 85.23910 0.8819939   80.21673   115.3   72.68437 1.503607          ?        ? 
1 1 1   14   11   13 o 86.81629 1.056484   111.7407    64.2   75.42094 1.834401          ?        ? 
1 1 1   14   11   14 o 95.16390 1.137613   82.54317     8.8   90.63744 2.165194          ?        ? 
1 1 1   14   11   15 o 73.51245 1.165865   99.79923   251.1   54.09978 1.714112          ?        ? 
1 1 1   14   11   16 o 54.29046 1.301693   69.52895   146.1   29.53085 1.413391          ?        ? 
1 1 1   14   11   17 o 43.15035 1.393831   49.82247   263.0   18.67480 1.202886          ?        ? 
1 1 1   14   11   18 o 31.67224 1.756538   45.00322   244.1   10.10424 1.112669          ?        ? 
1 1 1   14   11   19 o 45.80427 1.345899   41.26001   287.4   21.11065 1.232958          ?        ? 
1 1 1   14   11   20 o 9.647576 3.769565   12.41679   288.0  0.6916593 1.052525          ?        ? 
1 1 1   14   11   21 o 18.40059 3.396191   30.53043   186.1   3.728946 1.202886          ?        ? 
1 1 1   14   11   22 o 33.82005 1.867280   37.00737   354.9   11.81835 1.263030          ?        ? 
1 1 1   14   12    0 o 55.05494 2.220019   7.668533   360.0   30.46308 2.435844   30.46308 2.435844 
1 1 1   14   12    1 o 310.6390 3.049432   306.7415   256.6   965.5865 18.94545          ?        ? 
1 1 1   14   12    2 o 417.4110 3.285227   437.9258   319.2   1743.733 27.42579          ?        ? 
1 1 1   14   12    3 o 140.7961 1.324236   164.7984   225.0   198.2656 3.728946          ?        ? 
1 1 1   14   12    4 o 36.57885 1.233178   45.66621    24.9   13.38210 0.9021643          ?        ? 
1 1 1   14   12    5 o 45.28424 1.095724   54.47178   214.8   20.50920 0.9923807          ?        ? 
1 1 1   14   12    6 o 22.06779 1.703396   8.281988   179.3   4.871688 0.7518036          ?        ? 
1 1 1   14   12    7 o 34.06605 1.191726   47.88769   234.3   11.60785 0.8119479          ?        ? 
1 1 1   14   12    8 o 107.2104 1.051862   121.9677   205.5   114.9658 2.255411          ?        ? 
1 1 1   14   12    9 o 34.93884 0.8176727   47.60818   186.5   12.20929 0.5713707          ?        ? 
1 1 1   14   12   10 o 52.07700 0.7506920   73.49381   265.1   27.12507 0.7818757          ?        ? 
1 1 1   14   12   11 o 15.30659 1.669956   47.73999   292.6   2.345627 0.5112265          ?        ? 
1 1 1   14   12   12 o 31.77903 1.040918   45.26369    77.2   10.10424 0.6615872          ?        ? 
1 1 1   14   12   13 o 129.4090 1.150284   169.1830   290.2   167.5921 2.977142          ?        ? 
1 1 1   14   12   14 o 75.22633 0.9794012   90.71199   206.4   56.62585 1.473535          ?        ? 
1 1 1   14   12   15 o 155.9239 1.475411   184.6802   320.8   243.5844 4.601038          ?        ? 
1 1 1   14   12   16 o 25.52583 2.238402   20.26046   221.7   6.555727 1.142741          ?        ? 
1 1 1   14   12   17 o 7.476485 3.383034   12.55696   341.9 -0.5713707 1.082597          ?        ? 
1 1 1   14   12   18 o 37.62555 1.638458   33.63388   184.0   14.25420 1.232958          ?        ? 
1 1 1   14   12   19 o 25.73636 2.161668   29.77091   116.7   6.736160 1.112669          ?        ? 
1 1 1   14   12   20 o 11.97454 3.865705   20.43068   139.7   1.533679 1.052525          ?        ? 
1 1 1   14   12   21 o 13.04975 3.936675   7.630397   130.4   1.924617 1.112669          ?        ? 
1 1 1   14   12   22 o 9.786613 3.823211   11.58888   125.2  0.8720922 1.082597          ?        ? 
1 1 1   14   13    0 o 12.53386 5.949550   165.3158     0.0   2.315555 1.684040   2.315555 1.684040 
1 1 1   14   13    1 o 210.8030 1.990040   191.7103   272.5   444.5264 8.390128          ?        ? 
1 1 1   14   13    2 o 187.9342 1.728154   251.5330   285.7   353.2876 6.495584          ?        ? 
1 1 1   14   13    3 o 183.7059 1.841593   202.9065   338.1   337.5899 6.766232          ?        ? 
1 1 1   14   13    4 o 144.0233 1.378083   179.2529   276.1   207.4677 3.969523          ?        ? 
1 1 1   14   13    5 o 128.3376 1.253615   75.24185    95.5   164.7352 3.217719          ?        ? 
1 1 1   14   13    6 o 80.45815 1.009156   70.02812   112.8   64.74533 1.623896          ?        ? 
1 1 1   14   13    7 o 120.4783 1.198110   136.4618   160.3   145.1883 2.886926          ?        ? 
1 1 1   14   13    8 o 64.76140 1.021576   82.86566   245.6   41.95064 1.323174          ?        ? 
1 1 1   14   13    9 o 54.06004 0.8065959   58.43023   238.6   29.23012 0.8720922          ?        ? 
1 1 1   14   13   10 o 72.36957 0.8310716   49.08984   356.6   52.38567 1.202886          ?        ? 
1 1 1   14   13   11 o 110.9209 1.016676   119.7440   151.6   123.0853 2.255411          ?        ? 
1 1 1   14   13   12 o 82.67783 0.9093171   93.01267   325.7   68.38406 1.503607          ?        ? 
1 1 1   14   13   13 o 118.3401 1.092700   132.3266   169.9   140.1362 2.586205          ?        ? 
1 1 1   14   13   14 o 61.70774 0.9502970   64.99036   309.6   38.10141 1.172814          ?        ? 
1 1 1   14   13   15 o 88.26255 1.005102   94.67196   260.6   77.97707 1.774257          ?        ? 
1 1 1   14   13   16 o 111.4622 1.160126   98.04171   339.0   124.4385 2.586205          ?        ? 
1 1 1   14   13   17 o 46.17965 1.432638   45.35869    41.4   21.41137 1.323174          ?        ? 
1 1 1   14   13   18 o 51.45918 1.344093   62.21592   167.4   26.61385 1.383319          ?        ? 
1 1 1   14   13   19 o 40.98640 1.614163   44.91881   198.4   16.96069 1.323174          ?        ? 
1 1 1   14   13   20 o 37.16482 1.496939   48.96450   174.1   13.98355 1.112669          ?        ? 
1 1 1   14   13   21 o 43.63731 1.447191   45.04008     9.9   19.33639 1.263030          ?        ? 
1 1 1   14   13   22 o 14.93938 3.731099   3.823730   252.6   2.676421 1.112669          ?        ? 
1 1 1   14   14    0 o 15.29849 5.986514   76.66816   180.0   3.217719 1.744184   3.217719 1.744184 
1 1 1   14   14    1 o 67.95844 1.283273   109.3847   305.4   46.19081 1.744184          ?        ? 
1 1 1   14   14    2 o 82.56063 1.274851   77.56340    32.1   68.17355 2.105050          ?        ? 
1 1 1   14   14    3 o 175.4540 1.756811   213.1252     6.4   307.9388 6.164790          ?        ? 
1 1 1   14   14    4 o 198.7765 1.830564   208.7873   234.8   395.2683 7.277459          ?        ? 
1 1 1   14   14    5 o 261.0458 2.217575   271.0450   298.2   681.9160 11.57778          ?        ? 
1 1 1   14   14    6 o 99.19859 1.136816   124.4726   310.1   98.42612 2.255411          ?        ? 
1 1 1   14   14    7 o 283.0201 2.162278   345.5020   227.1   801.7234 12.23936          ?        ? 
1 1 1   14   14    8 o 164.6050 1.333657   262.0252   277.8   271.0703 4.390533          ?        ? 
1 1 1   14   14    9 o 67.66743 0.8666014   65.16580   289.4   45.79988 1.172814          ?        ? 
1 1 1   14   14   10 o 15.30450 1.866676   21.06994   185.0   2.345627 0.5713707          ?        ? 
1 1 1   14   14   11 o 7.307495 2.794894   30.97231   153.3  0.3608657 0.5713707          ?        ? 
1 1 1   14   14   12 o 82.90919 0.9430507   116.0580    25.1   68.77499 1.563751          ?        ? 
1 1 1   14   14   13 o 120.8627 1.094774   127.3417   136.1   146.1807 2.646349          ?        ? 
1 1 1   14   14   14 o 45.99257 1.078849   61.07700   342.2   21.17079 0.9923807          ?        ? 
1 1 1   14   14   15 o 5.351969 2.586749   5.791939   253.5  -1.353247 0.8420200          ?        ? 
1 1 1   14   14   16 o 12.15299 3.513310   20.45702   204.1   1.533679 0.9021643          ?        ? 
1 1 1   14   14   17 o 21.54841 2.163121   28.25173   120.0   4.691255 0.9322364          ?        ? 
1 1 1   14   14   18 o 44.63805 1.515799   51.00845   113.1   20.05812 1.353247          ?        ? 
1 1 1   14   14   19 o 11.08047 4.053840   14.42173   185.6   1.112669 1.172814          ?        ? 
1 1 1   14   14   20 o 46.49175 1.520045   48.02180   253.1   21.92259 1.413391          ?        ? 
1 1 1   14   14   21 o 8.117722 3.516245   5.651231   271.1       0.06 1.052525          ?        ? 
1 1 1   14   14   22 f 11.33800 3.919041   4.316992   150.4   1.503607 1.082597          ?        ? 
1 1 1   14   15    0 o 54.35045 1.607674   75.09872   180.0   29.62106 1.744184   29.62106 1.744184 
1 1 1   14   15    1 o 337.2458 2.750889   363.0481    94.6   1138.231 18.55451          ?        ? 
1 1 1   14   15    2 o 111.2856 1.310591   164.9016   104.2   123.8672 2.916998          ?        ? 
1 1 1   14   15    3 o 138.3316 1.565220   184.4538    97.2   191.4092 4.330389          ?        ? 
1 1 1   14   15    4 o 78.87082 1.258236   76.96874   268.3   62.21926 1.984761          ?        ? 
1 1 1   14   15    5 o 74.67939 1.208050   82.54971   297.3   55.78383 1.804329          ?        ? 
1 1 1   14   15    6 o 133.1546 1.400231   132.3407   153.9   177.3655 3.728946          ?        ? 
1 1 1   14   15    7 o 162.1644 1.446451   177.6610   139.1   263.1012 4.691255          ?        ? 
1 1 1   14   15    8 o 48.79768 0.8935798   23.03354   327.5   23.81714 0.8720922          ?        ? 
1 1 1   14   15    9 o 82.73730 0.9450099   113.9265   169.5   68.47427 1.563751          ?        ? 
1 1 1   14   15   10 o 52.18851 0.8931434   71.29844    27.0   27.24536 0.9322364          ?        ? 
1 1 1   14   15   11 o 133.1058 1.107040   150.1100   336.5   177.2753 2.947070          ?        ? 
1 1 1   14   15   12 o 68.40897 0.9451262   89.31927   302.0   46.82233 1.293102          ?        ? 
1 1 1   14   15   13 o 7.284666 2.981411   19.02542   233.7  0.1804329 0.6916593          ?        ? 
1 1 1   14   15   14 o 89.36867 1.009486   100.7395   269.5   79.93176 1.804329          ?        ? 
1 1 1   14   15   15 o 29.80177 1.463155   32.68287    89.5   8.901355 0.8720922          ?        ? 
1 1 1   14   15   16 o 66.81844 1.012630   97.72066   349.6   44.71728 1.353247          ?        ? 
1 1 1   14   15   17 o 7.466129 3.245005   16.22063    56.6 -0.1202886 0.9021643          ?        ? 
1 1 1   14   15   18 o 66.83665 1.102341   77.48682   333.6   44.83757 1.473535          ?        ? 
1 1 1   14   15   19 o 26.38056 2.279871   33.55080   227.4   7.127099 1.202886          ?        ? 
1 1 1   14   15   20 o 38.50058 1.718383   35.79941   237.1   15.09622 1.323174          ?        ? 
1 1 1   14   15   21 o 10.89906 4.044217   2.312541   296.0   1.202886 1.172814          ?        ? 
1 1 1   14   15   22 f 8.784801 3.646303   21.18207   218.9  0.5112265 1.052525          ?        ? 
1 1 1   14   16    0 o 215.1396 2.509812   208.1627     0.0   463.2013 10.79590   463.2013 10.79590 
1 1 1   14   16    1 o 154.7470 1.467200   220.4801    52.3   239.5246 4.540894          ?        ? 
1 1 1   14   16    2 o 53.41645 1.238546   43.13361    56.8   28.53847 1.323174          ?        ? 
1 1 1   14   16    3 o 228.6410 2.058375   197.9778   293.4   523.0749 9.412581          ?        ? 
1 1 1   14   16    4 o 145.5146 1.539622   148.6447   200.8   211.8282 4.480750          ?        ? 
1 1 1   14   16    5 o 62.58888 1.201178   112.7702   185.2   39.18401 1.503607          ?        ? 
1 1 1   14   16    6 o 237.7363 2.144069   251.5601   275.1   565.7172 10.19446          ?        ? 
1 1 1   14   16    7 o 57.82075 0.9621714   61.04538   265.5   33.44022 1.112669          ?        ? 
1 1 1   14   16    8 o 146.5902 1.374467   160.6996   163.5   215.0158 4.029667          ?        ? 
1 1 1   14   16    9 o 128.7682 1.237746   131.6646   257.4   165.9080 3.187647          ?        ? 
1 1 1   14   16   10 o 131.6987 1.187371   168.5571   348.4   173.5463 3.127503          ?        ? 
1 1 1   14   16   11 o 52.67369 0.9134623   55.98233   194.0   27.75659 0.9623086          ?        ? 
1 1 1   14   16   12 f 16.96800 2.215357   27.89014   108.4   2.886926 0.7518036          ?        ? 
1 1 1   14   16   13 o 48.32061 1.057989   43.68502    74.9   23.36606 1.022453          ?        ? 
1 1 1   14   16   14 o 40.60691 1.184908   44.93541   357.6   16.50961 0.9623086          ?        ? 
1 1 1   14   16   15 o 99.74267 1.085390   91.82721   263.9   99.62901 2.165194          ?        ? 
1 1 1   14   16   16 o 88.82586 1.032583   100.4445   307.7   79.02959 1.834401          ?        ? 
1 1 1   14   16   17 o 21.67886 2.150105   21.32795   252.9   4.751399 0.9322364          ?        ? 
1 1 1   14   16   18 o 29.50058 1.630999   38.09318   304.6   8.781067 0.9623086          ?        ? 
1 1 1   14   16   19 o 24.31313 2.102676   27.24515    33.2   6.044501 1.022453          ?        ? 
1 1 1   14   16   20 o 8.562943 3.757234   8.825439   357.9      -0.09 1.232958          ?        ? 
1 1 1   14   16   21 o 33.33478 1.939569   37.32056   246.3   11.48756 1.293102          ?        ? 
1 1 1   14   16   22 o 6.543270 3.069677   13.25754   301.4 -0.7518036 1.022453          ?        ? 
1 1 1   14   17    0 o 208.1008 2.385078   189.3678    -0.0   433.3997 9.923808   433.3997 9.923808 
1 1 1   14   17    1 o 89.27845 1.145241   139.6427    58.4   79.72126 2.044906          ?        ? 
1 1 1   14   17    2 o 233.1216 2.180061   227.7878   238.7   543.8547 10.16438          ?        ? 
1 1 1   14   17    3 o 13.31495 3.628412   77.36674    47.9   1.834401 0.9923807          ?        ? 
1 1 1   14   17    4 o 146.7537 1.598343   228.1777    15.7   215.4669 4.691255          ?        ? 
1 1 1   14   17    5 o 167.7065 1.712450   189.2228   249.1   281.4151 5.743780          ?        ? 
1 1 1   14   17    6 o 174.0986 1.640941   180.8158    59.2   303.3076 5.713707          ?        ? 
1 1 1   14   17    7 o 80.73267 1.024349   109.1037    10.7   65.19641 1.653968          ?        ? 
1 1 1   14   17    8 o 50.96413 1.032614   57.22623   206.1   25.98233 1.052525          ?        ? 
1 1 1   14   17    9 o 81.32273 0.9429586   95.79404   277.8   66.15872 1.533679          ?        ? 
1 1 1   14   17   10 o 117.0040 1.092327   143.2932    88.4   136.9786 2.556132          ?        ? 
1 1 1   14   17   11 f 106.8908 1.069074   105.5851   103.7   114.3343 2.285483          ?        ? 
1 1 1   14   17   12 o 111.1350 1.095894   108.0172   313.9   123.5965 2.435844          ?        ? 
1 1 1   14   17   13 o 89.11688 1.062955   103.8035   332.2   79.48067 1.894545          ?        ? 
1 1 1   14   17   14 o 46.37358 1.134833   69.47124    49.5   21.53165 1.052525          ?        ? 
1 1 1   14   17   15 o 6.661561 3.000532   22.66131   114.9 -0.4210100 0.8420200          ?        ? 
1 1 1   14   17   16 o 42.47929 1.309661   55.45307    99.7   18.10343 1.112669          ?        ? 
1 1 1   14   17   17 o 7.885778 3.329784   15.46334    53.5       0.09 0.9021643          ?        ? 
1 1 1   14   17   18 o 21.18073 2.271661   24.87243    21.8   4.570966 0.9623086          ?        ? 
1 1 1   14   17   19 o 9.965933 3.715717   4.232872   292.5  0.8720922 0.9923807          ?        ? 
1 1 1   14   17   20 o 15.70319 3.353932   25.12197    96.8   2.736565 1.022453          ?        ? 
1 1 1   14   17   21 o 13.00061 4.336606   15.92230   220.5   2.014834 1.323174          ?        ? 
1 1 1   14   18    0 o 351.7253 3.814260   354.6261     0.0   1239.093 26.82435   1239.093 26.82435 
1 1 1   14   18    1 o 220.6742 1.839699   237.1521   130.1   487.2590 8.119479          ?        ? 
1 1 1   14   18    2 o 79.45899 1.116461   65.83813   119.5   63.15150 1.774257          ?        ? 
1 1 1   14   18    3 o 64.87526 1.297906   46.10913    38.8   42.10100 1.684040          ?        ? 
1 1 1   14   18    4 o 174.7444 1.720922   186.5512    57.4   305.5330 6.014429          ?        ? 
1 1 1   14   18    5 o 201.0031 1.900052   231.5725   119.3   404.3801 7.638325          ?        ? 
1 1 1   14   18    6 o 139.6959 1.474590   168.5232   356.7   195.2584 4.119884          ?        ? 
1 1 1   14   18    7 o 73.62129 1.041600   79.51437    13.9   54.22008 1.533679          ?        ? 
1 1 1   14   18    8 o 89.92116 1.070169   97.93929   263.0   80.89407 1.924617          ?        ? 
1 1 1   14   18    9 o 8.420095 3.257345   20.59252    77.4  0.4510822 0.7818757          ?        ? 
1 1 1   14   18   10 o 49.73776 0.9673823   53.17973    16.6   24.74938 0.9623086          ?        ? 
1 1 1   14   18   11 o 43.95918 1.060343   72.69736   221.6   19.33639 0.9322364          ?        ? 
1 1 1   14   18   12 o 40.27757 1.231927   25.57443   276.2   16.23896 0.9923807          ?        ? 
1 1 1   14   18   13 o 67.13483 1.030254   88.02937   349.3   45.10822 1.383319          ?        ? 
1 1 1   14   18   14 o 41.76817 1.223962   34.02010   253.8   17.47192 1.022453          ?        ? 
1 1 1   14   18   15 o 81.76959 1.066524   80.17418    66.7   66.97066 1.744184          ?        ? 
1 1 1   14   18   16 f 28.03161 1.716471   37.32309    42.1   7.908974 0.9623086          ?        ? 
1 1 1   14   18   17 f 42.16443 1.283780   38.14598   162.9   17.86285 1.082597          ?        ? 
1 1 1   14   18   18 o 34.60025 1.607892   32.21663   201.3   12.08900 1.112669          ?        ? 
1 1 1   14   18   19 o 40.83336 1.436098   43.88560   111.9   16.87047 1.172814          ?        ? 
1 1 1   14   18   20 o 21.43598 2.525187   22.01841    61.6   4.811543 1.082597          ?        ? 
1 1 1   14   18   21 o 10.92052 3.953092   10.88997   121.4   1.323174 1.112669          ?        ? 
1 1 1   14   19    0 o 80.57224 1.643746   79.86156   180.0   65.01598 2.646349   65.01598 2.646349 
1 1 1   14   19    1 o 101.9910 1.208889   112.8235    99.9   104.0496 2.465916          ?        ? 
1 1 1   14   19    2 o 105.2119 1.200463   144.2816   149.7   110.7256 2.526060          ?        ? 
1 1 1   14   19    3 o 39.84046 1.283184   47.18976   235.7   15.87809 1.022453          ?        ? 
1 1 1   14   19    4 f 95.04160 1.297282   149.3239    83.6   90.36680 2.465916          ?        ? 
1 1 1   14   19    5 o 14.79757 3.588313   31.67962    79.5   2.285483 1.052525          ?        ? 
1 1 1   14   19    6 o 91.85878 1.096702   91.13176   252.2   84.41251 2.014834          ?        ? 
1 1 1   14   19    7 o 12.59692 3.212258   35.92257   144.7   1.653968 0.8119479          ?        ? 
1 1 1   14   19    8 o 28.21761 1.438726   16.21531    56.4   7.969118 0.8119479          ?        ? 
1 1 1   14   19    9 o 56.36375 1.067074   58.18750   229.5   31.78626 1.202886          ?        ? 
1 1 1   14   19   10 f 100.3324 1.138956   97.43700   228.6   100.7417 2.285483          ?        ? 
1 1 1   14   19   11 f 59.83193 0.9298291   52.23319   191.9   35.81593 1.112669          ?        ? 
1 1 1   14   19   12 o 64.79432 0.9978516   83.74294    66.4   42.01078 1.293102          ?        ? 
1 1 1   14   19   13 o 124.4598 1.232269   137.3003   175.4   155.1121 3.067359          ?        ? 
1 1 1   14   19   14 o 49.37529 1.157200   47.28547    83.9   24.41858 1.142741          ?        ? 
1 1 1   14   19   15 f 75.01791 1.122425   100.2742   255.2   56.38527 1.684040          ?        ? 
1 1 1   14   19   16 o 7.292426 3.206751   3.503268    91.7 -0.2105050 0.9021643          ?        ? 
1 1 1   14   19   17 o 52.37755 1.148284   65.82400   215.9   27.54608 1.202886          ?        ? 
1 1 1   14   19   18 f 22.87749 2.234626   29.28878   341.3   5.352841 1.022453          ?        ? 
1 1 1   14   19   19 o 15.96803 3.220321   18.54440   279.2   2.796710 0.9923807          ?        ? 
1 1 1   14   19   20 o 21.39033 2.319695   27.61973   171.1   4.781471 0.9923807          ?        ? 
1 1 1   14   19   21 o 20.76135 2.607242   19.89100   152.8   4.661182 1.082597          ?        ? 
1 1 1   14   20    0 o 103.4566 1.657794   91.69331   180.0   107.1470 3.428224   107.1470 3.428224 
1 1 1   14   20    1 o 196.7876 1.719171   222.8633   285.9   387.5096 6.766232          ?        ? 
1 1 1   14   20    2 o 167.2826 1.572975   166.3854   294.4   280.0017 5.262625          ?        ? 
1 1 1   14   20    3 o 300.8180 2.334251   301.2466   244.7   906.1639 14.04369          ?        ? 
1 1 1   14   20    4 o 75.83604 1.070662   58.35867   169.0   57.52802 1.623896          ?        ? 
1 1 1   14   20    5 o 63.01282 1.240820   80.49557   234.0   39.72530 1.563751          ?        ? 
1 1 1   14   20    6 o 24.08108 1.623423   57.31604    14.3   5.803924 0.7818757          ?        ? 
1 1 1   14   20    7 o 133.2878 1.308586   175.8132   204.7   177.7865 3.488369          ?        ? 
1 1 1   14   20    8 o 33.65678 1.384916   65.44157   190.2   11.33720 0.9322364          ?        ? 
1 1 1   14   20    9 o 63.55635 1.088261   81.56342   157.8   40.41696 1.383319          ?        ? 
1 1 1   14   20   10 o 92.73796 1.134945   112.3345   116.7   86.06648 2.105050          ?        ? 
1 1 1   14   20   11 o 36.31372 1.324993   2.299719    66.9   13.20167 0.9623086          ?        ? 
1 1 1   14   20   12 o 30.35983 1.485786   52.90276    41.1   9.232149 0.9021643          ?        ? 
1 1 1   14   20   13 o 84.31738 1.123461   98.13007   305.2   71.18076 1.894545          ?        ? 
1 1 1   14   20   14 o 78.42171 1.092881   80.28683   214.9   61.58775 1.714112          ?        ? 
1 1 1   14   20   15 o 54.39301 1.105736   60.39986   262.9   29.65113 1.202886          ?        ? 
1 1 1   14   20   16 o 45.52623 1.255036   45.59885   144.0   20.80992 1.142741          ?        ? 
1 1 1   14   20   17 o 50.34914 1.164681   55.78546   159.8   25.47111 1.172814          ?        ? 
1 1 1   14   20   18 o 29.13549 1.806259   29.90834   135.3   8.630706 1.052525          ?        ? 
1 1 1   14   20   19 o 24.80406 2.061059   27.36303    97.0   6.315150 1.022453          ?        ? 
1 1 1   14   20   20 o 19.98701 2.633023   21.74748   344.8   4.240172 1.052525          ?        ? 
1 1 1   14   20   21 o 12.52224 3.904722   5.057417   297.3   1.924617 1.082597          ?        ? 
1 1 1   14   21    0 o 34.63042 2.233397   41.08502   360.0   12.14915 1.533679   12.14915 1.533679 
1 1 1   14   21    1 o 198.0636 1.738462   251.7224   293.8   392.5919 6.886521          ?        ? 
1 1 1   14   21    2 o 200.1659 1.765274   232.5174   102.9   400.9820 7.066954          ?        ? 
1 1 1   14   21    3 o 205.5273 1.777752   207.1802    52.3   422.7843 7.307531          ?        ? 
1 1 1   14   21    4 o 50.72485 1.185697   74.91507   328.0   25.74175 1.202886          ?        ? 
1 1 1   14   21    5 o 128.8919 1.201561   129.3486   215.9   166.2087 3.097431          ?        ? 
1 1 1   14   21    6 o 40.95111 1.211665   35.60066   196.7   16.78026 0.9923807          ?        ? 
1 1 1   14   21    7 o 30.37011 1.534793   22.77660    88.9   9.232149 0.9322364          ?        ? 
1 1 1   14   21    8 o 89.07337 1.147877   116.1619   249.4   79.39046 2.044906          ?        ? 
1 1 1   14   21    9 o 40.68789 1.219504   70.72677   348.8   16.56975 0.9923807          ?        ? 
1 1 1   14   21   10 o 14.88507 3.222448   33.78133   280.6   2.315555 0.9322364          ?        ? 
1 1 1   14   21   11 o 11.18871 3.698271   31.53527   336.0   1.202886 0.9623086          ?        ? 
1 1 1   14   21   12 o 38.08578 1.263344   42.05648   299.1   14.52485 0.9623086          ?        ? 
1 1 1   14   21   13 o 63.45921 1.137316   51.36229   163.5   40.32675 1.443463          ?        ? 
1 1 1   14   21   14 o 50.77487 1.154916   54.29421     1.5   25.83197 1.172814          ?        ? 
1 1 1   14   21   15 o 26.32228 1.770813   28.91751    49.1   6.976738 0.9322364          ?        ? 
1 1 1   14   21   16 o 19.82222 2.503202   16.32943   354.9   3.999595 0.9923807          ?        ? 
1 1 1   14   21   17 o 67.08380 1.165521   69.34649    56.9   45.22850 1.563751          ?        ? 
1 1 1   14   21   18 o 5.300734 2.610551   8.784070   195.0  -1.894545 0.9623086          ?        ? 
1 1 1   14   21   19 o 24.55357 2.020848   15.28710    24.8   6.194862 0.9923807          ?        ? 
1 1 1   14   21   20 f 21.66424 2.567986   23.54731   247.5   4.991976 1.112669          ?        ? 
1 1 1   14   22    0 f 150.9676 2.082486   112.8120   180.0   228.1874 6.285078   228.1874 6.285078 
1 1 1   14   22    1 o 116.2751 1.267283   123.9836   258.2   135.2645 2.947070          ?        ? 
1 1 1   14   22    2 o 121.4536 1.337051   141.6139   275.4   147.5941 3.247792          ?        ? 
1 1 1   14   22    3 f 132.7638 1.393028   158.3711    44.6   176.3731 3.698874          ?        ? 
1 1 1   14   22    4 o 131.5716 1.348510   136.3859   159.6   173.2156 3.548513          ?        ? 
1 1 1   14   22    5 o 55.77713 1.024382   68.08510     7.1   31.12467 1.142741          ?        ? 
1 1 1   14   22    6 o 60.33431 1.021772   60.88410    89.4   36.41737 1.232958          ?        ? 
1 1 1   14   22    7 o 64.40214 1.073970   94.30133   281.3   41.49956 1.383319          ?        ? 
1 1 1   14   22    8 o 77.25533 1.109381   99.80035   330.4   59.72328 1.714112          ?        ? 
1 1 1   14   22    9 o 83.28062 1.137447   99.07068   320.6   69.40651 1.894545          ?        ? 
1 1 1   14   22   10 o 53.79112 1.146061   53.84971   151.3   28.95948 1.232958          ?        ? 
1 1 1   14   22   11 o 23.99149 2.068193   38.08960   108.1   5.773852 0.9923807          ?        ? 
1 1 1   14   22   12 o 83.72552 1.149361   85.09900   149.0   70.18839 1.924617          ?        ? 
1 1 1   14   22   13 f 67.33309 1.138875   69.58530   249.1   45.40894 1.533679          ?        ? 
1 1 1   14   22   14 o 49.57422 1.182887   56.26773   211.4   24.62909 1.172814          ?        ? 
1 1 1   14   22   15 o 26.34982 1.997215   36.62315   183.0   7.006810 1.052525          ?        ? 
1 1 1   14   22   16 o 29.60620 1.675968   28.83963   123.2   8.841210 0.9923807          ?        ? 
1 1 1   14   22   17 f 23.07191 2.280966   26.13013     1.9   5.443058 1.052525          ?        ? 
1 1 1   14   22   18 o 31.69107 1.708048   28.32176    11.6   10.22453 1.082597          ?        ? 
1 1 1   14   22   19 o 32.07637 1.828158   34.88326   220.4   10.55532 1.172814          ?        ? 
1 1 1   14   22   20 o 24.98445 2.286906   24.03613   148.1   6.615872 1.142741          ?        ? 
1 1 1   14   23    0 o 192.1713 2.363743   220.9977   180.0   369.7971 9.081788   369.7971 9.081788 
1 1 1   14   23    1 o 275.4963 2.281366   275.9469   162.9   760.2539 12.57016          ?        ? 
1 1 1   14   23    2 o 155.6853 1.506647   134.7868   314.1   242.5619 4.691255          ?        ? 
1 1 1   14   23    3 o 129.4359 1.347528   173.4974    96.4   167.6522 3.488369          ?        ? 
1 1 1   14   23    4 o 25.58360 1.939486   34.56300   284.7   6.555727 0.9923807          ?        ? 
1 1 1   14   23    5 o 126.7830 1.162250   143.9599   355.4   160.8258 2.947070          ?        ? 
1 1 1   14   23    6 f 100.9120 1.028113   94.22675   335.2   101.8844 2.074978          ?        ? 
1 1 1   14   23    7 o 16.33084 2.670078   24.54208    28.3   2.676421 0.8720922          ?        ? 
1 1 1   14   23    8 o 44.79756 1.309015   47.95009   221.0   20.08819 1.172814          ?        ? 
1 1 1   14   23    9 o 46.47752 1.261700   53.36077    94.7   21.62187 1.172814          ?        ? 
1 1 1   14   23   10 o 84.91850 1.133214   87.80301    24.2   72.17315 1.924617          ?        ? 
1 1 1   14   23   11 o 20.17148 2.459861   24.57788   288.3   4.089812 0.9923807          ?        ? 
1 1 1   14   23   12 o 88.63591 1.136579   98.96281   236.1   78.66873 2.014834          ?        ? 
1 1 1   14   23   13 o 74.68464 1.288496   64.45184    76.1   55.90411 1.924617          ?        ? 
1 1 1   14   23   14 o 16.43533 3.318246   30.24638   152.5   2.856854 1.052525          ?        ? 
1 1 1   14   23   15 o 36.52679 1.399593   42.57195    74.0   13.41218 1.022453          ?        ? 
1 1 1   14   23   16 o 41.76844 1.367948   47.84917    25.8   17.56213 1.142741          ?        ? 
1 1 1   14   23   17 o 10.41637 3.685598   20.32729   268.8   1.052525 0.9623086          ?        ? 
1 1 1   14   23   18 o 27.30751 1.982234   32.29713   125.7   7.638325 1.082597          ?        ? 
1 1 1   14   23   19 o 32.25973 1.724548   28.06593    75.3   10.67561 1.112669          ?        ? 
1 1 1   14   23   20 o 24.26633 2.354583   26.65345    27.5   6.285078 1.142741          ?        ? 
1 1 1   14   24    0 o 24.14917 3.008969   40.57265   180.0   5.894140 1.473535   5.894140 1.473535 
1 1 1   14   24    1 o 39.10418 1.538053   37.11139   144.9   15.30672 1.202886          ?        ? 
1 1 1   14   24    2 o 26.89647 2.068430   26.29204   169.1   7.247387 1.112669          ?        ? 
1 1 1   14   24    3 o 45.86499 1.311333   62.73842   220.3   21.05050 1.202886          ?        ? 
1 1 1   14   24    4 o 42.46037 1.381069   51.21624   308.4   18.04329 1.172814          ?        ? 
1 1 1   14   24    5 o 47.22299 1.114420   47.04466   233.1   22.31353 1.052525          ?        ? 
1 1 1   14   24    6 f 74.12502 0.9939526   91.75497   317.9   54.97188 1.473535          ?        ? 
1 1 1   14   24    7 o 134.3319 1.231255   151.0713    64.5   180.6133 3.307936          ?        ? 
1 1 1   14   24    8 o 99.16263 1.076576   114.9418   118.5   98.39606 2.135122          ?        ? 
1 1 1   14   24    9 o 37.16551 1.496911   29.18391   257.8   13.83319 1.112669          ?        ? 
1 1 1   14   24   10 o 16.30149 3.156486   38.08173   313.7   2.766637 0.9923807          ?        ? 
1 1 1   14   24   11 o 60.64614 1.289242   65.11374   219.4   36.83838 1.563751          ?        ? 
1 1 1   14   24   12 o 97.35210 1.189268   94.38068    67.3   94.93777 2.315555          ?        ? 
1 1 1   14   24   13 o 44.93227 1.606265   48.86782   303.5   20.26863 1.443463          ?        ? 
1 1 1   14   24   14 o 28.11935 1.871532   37.99289    53.1   7.969118 1.052525          ?        ? 
1 1 1   14   24   15 o 28.02401 1.931553   44.12077   240.7   7.939046 1.082597          ?        ? 
1 1 1   14   24   16 o 46.46471 1.229688   44.51955   288.1   21.71209 1.142741          ?        ? 
1 1 1   14   24   17 o 23.88051 2.077804   28.05981    74.8   5.833996 0.9923807          ?        ? 
1 1 1   14   24   18 o 26.05580 2.192873   20.45227   104.2   7.006810 1.142741          ?        ? 
1 1 1   14   24   19 o 11.19089 3.864609   11.55479   119.5   1.383319 1.052525          ?        ? 
1 1 1   14   24   20 o 32.25724 1.817908   33.54712   114.1   10.85604 1.172814          ?        ? 
1 1 1   14   25    0 o 265.3278 3.055411   285.8311   180.0   705.5828 16.20889   705.5828 16.20889 
1 1 1   14   25    1 o 86.43900 1.182861   100.6013   309.9   74.75935 2.044906          ?        ? 
1 1 1   14   25    2 o 74.98587 1.223164   64.17537   204.6   56.26498 1.834401          ?        ? 
1 1 1   14   25    3 o 71.95945 1.149236   74.12415   259.2   51.81431 1.653968          ?        ? 
1 1 1   14   25    4 o 72.68888 1.096333   78.36486   232.9   52.86683 1.593824          ?        ? 
1 1 1   14   25    5 o 102.7666 1.082715   103.5818   235.9   105.6735 2.225339          ?        ? 
1 1 1   14   25    6 o 11.68827 3.548557   24.09597   102.3   1.383319 0.9021643          ?        ? 
1 1 1   14   25    7 o 96.28667 1.093116   97.51141   106.0   92.77257 2.105050          ?        ? 
1 1 1   14   25    8 o 52.92057 1.079676   41.01550    10.7   28.02724 1.142741          ?        ? 
1 1 1   14   25    9 o 130.2439 1.235267   125.6533   353.8   169.8174 3.217719          ?        ? 
1 1 1   14   25   10 o 59.82713 1.281759   84.75284    72.1   35.84600 1.533679          ?        ? 
1 1 1   14   25   11 o 131.2071 1.283497   138.9821    39.4   172.4637 3.368080          ?        ? 
1 1 1   14   25   12 o 24.99376 2.105575   44.30782   356.6   6.285078 1.052525          ?        ? 
1 1 1   14   25   13 o 10.67369 3.796768   15.99258   317.0   1.022453 1.022453          ?        ? 
1 1 1   14   25   14 o 11.18480 4.147340   19.33281   323.9   1.052525 1.232958          ?        ? 
1 1 1   14   25   15 o 15.25761 3.250152   13.27752    31.4   2.495988 0.9623086          ?        ? 
1 1 1   14   25   16 o 16.18449 3.179134   18.63971   350.2   2.826782 0.9923807          ?        ? 
1 1 1   14   25   17 o 30.77223 1.759049   23.54222    39.4   9.653158 1.082597          ?        ? 
1 1 1   14   25   18 o 7.317449 3.321449   3.466584    30.7 -0.4210100 1.052525          ?        ? 
1 1 1   14   25   19 o 30.25962 1.987609   39.40247    47.7   9.562942 1.202886          ?        ? 
1 1 1   14   26    0 o 60.87534 1.905993   133.7489   180.0   37.19924 2.315555   37.19924 2.315555 
1 1 1   14   26    1 o 30.60536 1.866897   30.42843    74.5   9.382509 1.142741          ?        ? 
1 1 1   14   26    2 o 28.88285 2.134412   11.85950   102.7   8.360056 1.232958          ?        ? 
1 1 1   14   26    3 o 108.3358 1.290759   139.9758   150.5   117.4618 2.796710          ?        ? 
1 1 1   14   26    4 o 136.7500 1.231473   135.8082   238.4   187.1690 3.368080          ?        ? 
1 1 1   14   26    5 o 34.96435 1.419132   32.54656    48.6   12.23936 0.9923807          ?        ? 
1 1 1   14   26    6 o 78.64510 1.051539   78.49693    29.4   61.88847 1.653968          ?        ? 
1 1 1   14   26    7 o 57.88316 1.091017   40.62734   339.9   33.53044 1.263030          ?        ? 
1 1 1   14   26    8 o 39.82368 1.321481   28.55857   139.3   15.87809 1.052525          ?        ? 
1 1 1   14   26    9 o 105.3942 1.169854   115.3985    95.2   111.2068 2.465916          ?        ? 
1 1 1   14   26   10 o 39.24080 1.379428   27.60715   328.3   15.42701 1.082597          ?        ? 
1 1 1   14   26   11 o 26.63073 2.032609   43.62657   283.7   7.127099 1.082597          ?        ? 
1 1 1   14   26   12 o 76.60528 1.236563   73.67041   312.9   58.82112 1.894545          ?        ? 
1 1 1   14   26   13 o 40.31393 1.454601   35.55960    80.7   16.32917 1.172814          ?        ? 
1 1 1   14   26   14 o 28.72338 2.146262   38.19929   306.5   8.360056 1.232958          ?        ? 
1 1 1   14   26   15 o 22.53011 2.269081   20.97843   260.7   5.172409 1.022453          ?        ? 
1 1 1   14   26   16 o 10.34193 3.832462   17.53362   279.6  0.9623086 1.052525          ?        ? 
1 1 1   14   26   17 o 18.77634 2.802796   16.52760   295.1   3.698874 1.052525          ?        ? 
1 1 1   14   26   18 o 35.89550 1.675538   41.39512   321.6   13.20167 1.202886          ?        ? 
1 1 1   14   26   19 o 21.76311 2.556320   20.41185   310.6   5.112265 1.112669          ?        ? 
1 1 1   14   27    0 o 103.1807 1.852048   70.71799    -0.0   106.6659 3.819162   106.6659 3.819162 
1 1 1   14   27    1 o 77.26958 1.187014   89.50404    93.5   59.75335 1.834401          ?        ? 
1 1 1   14   27    2 f 96.50895 1.230818   83.64278   148.0   93.22365 2.375700          ?        ? 
1 1 1   14   27    3 o 82.51267 1.220924   54.51432   118.4   68.14348 2.014834          ?        ? 
1 1 1   14   27    4 o 22.11261 2.107929   57.12848    77.9   4.901759 0.9322364          ?        ? 
1 1 1   14   27    5 o 62.62440 1.080447   65.50082   135.7   39.24415 1.353247          ?        ? 
1 1 1   14   27    6 o 80.49073 1.064789   83.29096   133.8   64.83555 1.714112          ?        ? 
1 1 1   14   27    7 o 55.49272 1.192205   70.70691   187.3   30.82395 1.323174          ?        ? 
1 1 1   14   27    8 f 30.69460 1.665526   32.21288   343.7   9.442654 1.022453          ?        ? 
1 1 1   14   27    9 o 47.10276 1.308796   38.37228   214.3   22.22332 1.232958          ?        ? 
1 1 1   14   27   10 f 8.820916 3.619997   3.623672   155.2  0.2706493 1.022453          ?        ? 
1 1 1   14   27   11 o 42.24141 1.352632   32.63451   197.2   17.89293 1.142741          ?        ? 
1 1 1   14   27   12 o 15.41206 3.407899   27.24154   200.7   2.526060 1.022453          ?        ? 
1 1 1   14   27   13 o 46.26435 1.332514   56.41687   170.7   21.50158 1.232958          ?        ? 
1 1 1   14   27   14 o 34.14354 1.849589   37.32777    33.9   11.78828 1.263030          ?        ? 
1 1 1   14   27   15 o 13.83621 3.870569   19.23783   187.3   2.105050 1.112669          ?        ? 
1 1 1   14   27   16 o 22.73442 2.447104   23.37258   222.6   5.352841 1.112669          ?        ? 
1 1 1   14   27   17 o 19.09218 2.598920   16.37026   258.4   3.819162 0.9923807          ?        ? 
1 1 1   14   27   18 o 15.57292 3.794990   19.15781   351.9   2.856854 1.172814          ?        ? 
1 1 1   14   28    0 o 54.12924 1.921985   81.91615     0.0   29.44063 2.074978   29.44063 2.074978 
1 1 1   14   28    1 o 102.4592 1.262066   107.9079   276.3   105.0721 2.586205          ?        ? 
1 1 1   14   28    2 o 77.94536 1.234594   67.95753   250.2   60.80587 1.924617          ?        ? 
1 1 1   14   28    3 o 52.74239 1.368409   49.60440   180.8   27.84681 1.443463          ?        ? 
1 1 1   14   28    4 o 90.02557 1.085630   93.96306    90.9   81.10458 1.954689          ?        ? 
1 1 1   14   28    5 f 48.40823 1.211378   47.87824    75.0   23.45627 1.172814          ?        ? 
1 1 1   14   28    6 o 26.82977 1.961488   28.62247    78.6   7.217315 1.052525          ?        ? 
1 1 1   14   28    7 o 145.4014 1.313317   154.0249   153.8   211.7079 3.819162          ?        ? 
1 1 1   14   28    8 o 40.96229 1.394870   42.27291    32.9   16.81033 1.142741          ?        ? 
1 1 1   14   28    9 f 33.17047 1.631869   46.29374    25.1   11.03648 1.082597          ?        ? 
1 1 1   14   28   10 o 50.32733 1.254815   60.04903   294.1   25.38089 1.263030          ?        ? 
1 1 1   14   28   11 o 44.11203 1.329358   56.04847   117.0   19.51682 1.172814          ?        ? 
1 1 1   14   28   12 o 29.06431 1.810683   37.88995   246.8   8.510417 1.052525          ?        ? 
1 1 1   14   28   13 o 37.28671 1.411394   34.57898   269.1   13.98355 1.052525          ?        ? 
1 1 1   14   28   14 o 50.15922 1.318974   38.02645   149.0   25.32075 1.323174          ?        ? 
1 1 1   14   28   15 o 10.94308 4.128813   13.36639   219.4   1.052525 1.232958          ?        ? 
1 1 1   14   28   16 o 20.93881 3.016002   14.57745   103.5   4.631110 1.263030          ?        ? 
1 1 1   14   28   17 o 11.39766 3.969872   13.29294   265.3   1.413391 1.112669          ?        ? 
1 1 1   14   28   18 o 11.08680 4.054066   12.44618   326.4   1.383319 1.172814          ?        ? 
1 1 1   14   29    0 o 100.3509 1.904434   85.96861   180.0   100.9221 3.819162   100.9221 3.819162 
1 1 1   14   29    1 o 96.33932 1.186163   92.97138     7.0   92.89285 2.285483          ?        ? 
1 1 1   14   29    2 o 80.79955 1.209592   87.04039    19.8   65.34677 1.954689          ?        ? 
1 1 1   14   29    3 o 18.05588 3.540499   10.69828   246.8   3.398152 1.232958          ?        ? 
1 1 1   14   29    4 o 32.27326 1.677236   38.58706   304.2   10.43503 1.082597          ?        ? 
1 1 1   14   29    5 o 47.24158 1.273122   56.41754   307.3   22.34361 1.202886          ?        ? 
1 1 1   14   29    6 o 99.88370 1.113965   88.27785   320.3   99.86959 2.225339          ?        ? 
1 1 1   14   29    7 o 70.58958 1.128937   85.11845   306.9   49.88969 1.593824          ?        ? 
1 1 1   14   29    8 o 8.827786 3.620934   17.73399   175.0  0.2706493 1.022453          ?        ? 
1 1 1   14   29    9 f 63.17245 1.094875   50.60068   191.2   39.96588 1.383319          ?        ? 
1 1 1   14   29   10 o 61.15792 1.081769   62.24540   145.1   37.46989 1.323174          ?        ? 
1 1 1   14   29   11 o 30.57937 1.720972   39.81985   160.1   9.412581 1.052525          ?        ? 
1 1 1   14   29   12 o 55.86557 1.211163   55.76339   166.0   31.33517 1.353247          ?        ? 
1 1 1   14   29   13 o 80.66664 1.118386   82.72604    77.7   65.34677 1.804329          ?        ? 
1 1 1   14   29   14 o 47.84316 1.414253   50.61961   110.1   23.09541 1.353247          ?        ? 
1 1 1   14   29   15 o 30.61450 1.866341   26.24385   220.3   9.562942 1.142741          ?        ? 
1 1 1   14   29   16 o 5.478794 2.704839   7.463773     6.6  -2.255411 1.082597          ?        ? 
1 1 1   14   29   17 o 23.13215 2.080024   24.31893   131.3   5.563347 0.9623086          ?        ? 
1 1 1   14   29   18 o 13.05243 3.936513   16.71847   286.0   2.105050 1.112669          ?        ? 
1 1 1   14   30    0 o 13.74375 6.022526   14.58027   360.0   2.736565 1.714112   2.736565 1.714112 
1 1 1   14   30    1 o 130.3071 1.326980   138.5367   157.2   169.9978 3.458297          ?        ? 
1 1 1   14   30    2 o 60.18505 1.349086   58.95163   109.1   36.26701 1.623896          ?        ? 
1 1 1   14   30    3 o 88.04428 1.110060   73.74819    27.5   77.58614 1.954689          ?        ? 
1 1 1   14   30    4 o 37.84042 1.509948   28.73768   122.8   14.34441 1.142741          ?        ? 
1 1 1   14   30    5 o 41.83518 1.401708   51.56382   137.9   17.53206 1.172814          ?        ? 
1 1 1   14   30    6 o 112.4584 1.163220   97.25895   150.6   126.6338 2.616277          ?        ? 
1 1 1   14   30    7 o 54.79339 1.207422   96.80352   341.7   30.07215 1.323174          ?        ? 
1 1 1   14   30    8 o 48.03664 1.345954   57.23822    23.8   23.12548 1.293102          ?        ? 
1 1 1   14   30    9 o 20.48234 2.642757   28.68123   199.3   4.240172 1.082597          ?        ? 
1 1 1   14   30   10 o 33.61032 1.699986   34.86340   342.7   11.36727 1.142741          ?        ? 
1 1 1   14   30   11 o 46.46789 1.294319   32.30754   132.1   21.68202 1.202886          ?        ? 
1 1 1   14   30   12 o 37.17401 1.577465   33.46820     0.8   13.92340 1.172814          ?        ? 
1 1 1   14   30   13 f 18.72299 2.810783   22.48999   287.2   3.608657 1.052525          ?        ? 
1 1 1   14   30   14 o 8.476087 3.667551   8.650240   265.6   0.000000 1.142741          ?        ? 
1 1 1   14   30   15 o 31.67139 1.899010   28.65451   131.6   10.25460 1.202886          ?        ? 
1 1 1   14   30   16 o 19.81212 2.959839   15.22474    33.7   4.210100 1.172814          ?        ? 
1 1 1   14   30   17 o 11.00861 3.808292   12.31305    21.5   1.383319 1.022453          ?        ? 
1 1 1   14   31    0 o 83.35416 1.715302   80.68298   360.0   69.64709 2.856854   69.64709 2.856854 
1 1 1   14   31    1 o 18.60695 3.522040   20.87038   234.3   3.608657 1.263030          ?        ? 
1 1 1   14   31    2 o 53.17855 1.442009   54.18227    69.1   28.32796 1.533679          ?        ? 
1 1 1   14   31    3 o 74.06177 1.116614   73.67798    95.0   54.91174 1.653968          ?        ? 
1 1 1   14   31    4 o 26.41468 2.106157   29.62327   151.0   7.006810 1.112669          ?        ? 
1 1 1   14   31    5 o 42.28937 1.493318   23.53918   255.9   17.92300 1.263030          ?        ? 
1 1 1   14   31    6 o 86.08172 1.152836   90.13206   134.7   74.21806 1.984761          ?        ? 
1 1 1   14   31    7 o 53.14341 1.273203   38.49850   274.7   28.29789 1.353247          ?        ? 
1 1 1   14   31    8 o 53.30488 1.212930   45.44807    89.9   28.47832 1.293102          ?        ? 
1 1 1   14   31    9 o 18.26882 2.962963   7.453358    28.9   3.398152 1.082597          ?        ? 
1 1 1   14   31   10 o 28.99697 1.918596   21.95856     0.7   8.480345 1.112669          ?        ? 
1 1 1   14   31   11 o 28.70607 1.938038   30.81684     7.0   8.329985 1.112669          ?        ? 
1 1 1   14   31   12 o 32.90548 1.736400   34.95690   161.5   10.94626 1.142741          ?        ? 
1 1 1   14   31   13 o 46.42915 1.327784   44.66194   308.0   21.74216 1.232958          ?        ? 
1 1 1   14   31   14 o 22.09278 2.790409   24.41350   358.4   5.112265 1.232958          ?        ? 
1 1 1   14   31   15 o 57.95772 1.349045   56.46804    15.1   34.01160 1.563751          ?        ? 
1 1 1   14   31   16 o 28.11953 2.245823   22.07326   356.7   8.269840 1.263030          ?        ? 
1 1 1   14   31   17 o 22.81581 2.636080   24.09878   243.5   5.653563 1.202886          ?        ? 
1 1 1   14   32    0 o 19.52426 5.519541   19.10403   360.0   4.661182 1.864473   4.661182 1.864473 
1 1 1   14   32    1 o 94.41311 1.305918   97.53614   320.6   89.28419 2.465916          ?        ? 
1 1 1   14   32    2 o 19.80931 3.543696   20.97498   347.9   4.089812 1.353247          ?        ? 
1 1 1   14   32    3 o 81.17762 1.111346   80.26487   262.0   65.97829 1.804329          ?        ? 
1 1 1   14   32    4 o 74.16883 1.155548   83.52077   166.2   55.09217 1.714112          ?        ? 
1 1 1   14   32    5 o 13.02818 3.937981   44.28129   251.2   1.744184 1.112669          ?        ? 
1 1 1   14   32    6 o 111.3214 1.148087   101.3130    27.1   124.1378 2.556132          ?        ? 
1 1 1   14   32    7 o 44.88596 1.406932   20.16827    44.1   20.20848 1.263030          ?        ? 
1 1 1   14   32    8 o 6.239877 2.975951   5.431953   241.1  -1.293102 1.022453          ?        ? 
1 1 1   14   32    9 o 6.445446 3.014524   12.24010   206.1 -0.9021643 0.9623086          ?        ? 
1 1 1   14   32   10 o 50.81556 1.331528   40.60035   135.6   25.95226 1.353247          ?        ? 
1 1 1   14   32   11 o 23.49025 2.368364   20.62206    97.4   5.623491 1.112669          ?        ? 
1 1 1   14   32   12 o 19.91892 2.717510   19.45682   194.0   4.089812 1.082597          ?        ? 
1 1 1   14   32   13 o 35.12757 1.754972   25.94342   128.6   12.54008 1.232958          ?        ? 
1 1 1   14   32   14 o 30.42719 1.927246   34.27842   272.2   9.472726 1.172814          ?        ? 
1 1 1   14   32   15 o 7.946091 3.561637   1.401609    89.3 -0.2706493 1.172814          ?        ? 
1 1 1   14   32   16 o 11.14736 4.102827   9.132681   136.1   1.383319 1.202886          ?        ? 
1 1 1   14   33    0 o 8.456707 5.371544   28.56679    -0.0  0.3608657 1.924617  0.3608657 1.924617 
1 1 1   14   33    1 o 43.96017 1.778600   37.20549   180.1   19.39653 1.563751          ?        ? 
1 1 1   14   33    2 o 39.12279 1.806352   42.28414   140.0   15.36687 1.413391          ?        ? 
1 1 1   14   33    3 o 42.59456 1.517920   31.10053   256.1   18.19365 1.293102          ?        ? 
1 1 1   14   33    4 o 72.46717 1.120436   75.69534    49.2   52.59618 1.623896          ?        ? 
1 1 1   14   33    5 o 89.29948 1.144971   89.22488   339.2   79.90170 2.044906          ?        ? 
1 1 1   14   33    6 o 19.65687 2.753737   21.38783   210.3   3.909379 1.082597          ?        ? 
1 1 1   14   33    7 o 50.56289 1.248969   43.75359   235.1   25.65154 1.263030          ?        ? 
1 1 1   14   33    8 o 54.85631 1.206037   52.24168   133.9   30.19243 1.323174          ?        ? 
1 1 1   14   33    9 o 7.333633 3.281943   7.080916   192.1 -0.3909379 0.9923807          ?        ? 
1 1 1   14   33   10 o 30.99542 1.843404   27.71542   208.5   9.713303 1.142741          ?        ? 
1 1 1   14   33   11 o 39.07270 1.500810   42.07074   215.9   15.39694 1.172814          ?        ? 
1 1 1   14   33   12 o 39.53633 1.521241   39.38214   214.1   15.81795 1.202886          ?        ? 
1 1 1   14   33   13 o 52.46370 1.232378   50.56357   196.7   27.78666 1.293102          ?        ? 
1 1 1   14   33   14 o 20.50878 3.152557   21.65878   179.8   4.510822 1.293102          ?        ? 
1 1 1   14   33   15 o 23.28041 2.648059   24.03093    49.1   5.773852 1.232958          ?        ? 
1 1 1   14   33   16 f 24.12143 2.618066   27.23922   231.4   6.315150 1.263030          ?        ? 
1 1 1   14   34    0 o 71.33044 2.090829   64.29688   180.0   51.15272 2.977142   51.15272 2.977142 
1 1 1   14   34    1 o 89.69552 1.274023   89.96398    63.9   80.62342 2.285483          ?        ? 
1 1 1   14   34    2 o 9.958491 4.107701   11.75895   300.3  0.3307936 1.323174          ?        ? 
1 1 1   14   34    3 o 25.62888 2.170734   37.19015   249.7   6.615872 1.112669          ?        ? 
1 1 1   14   34    4 o 49.32000 1.310931   43.53767   225.7   24.38851 1.293102          ?        ? 
1 1 1   14   34    5 o 72.33286 1.143303   56.41043    44.7   52.44582 1.653968          ?        ? 
1 1 1   14   34    6 f 20.07077 2.622035   5.011416   126.9   4.089812 1.052525          ?        ? 
1 1 1   14   34    7 o 33.05408 1.774083   42.87297   276.6   11.00640 1.172814          ?        ? 
1 1 1   14   34    8 o 21.09185 2.708965   24.46904   104.7   4.540894 1.142741          ?        ? 
1 1 1   14   34    9 o 29.31167 1.897997   28.71918   155.0   8.690849 1.112669          ?        ? 
1 1 1   14   34   10 o 53.06434 1.275100   56.43216   317.1   28.32796 1.353247          ?        ? 
1 1 1   14   34   11 o 12.15869 4.030097   23.54112   104.8   1.563751 1.142741          ?        ? 
1 1 1   14   34   12 f 24.11215 2.556715   29.07015    49.0   6.044501 1.232958          ?        ? 
1 1 1   14   34   13 o 12.79236 3.753848   10.81751    42.6   1.834401 1.022453          ?        ? 
1 1 1   14   34   14 f 30.70038 2.057027   30.88162   296.4   9.773447 1.263030          ?        ? 
1 1 1   14   34   15 o 24.00917 2.692934   23.14330   264.4   6.255006 1.293102          ?        ? 
1 1 1   14   35    0 f 40.24730 2.714978   34.47500   360.0   16.50961 2.165194   16.50961 2.165194 
1 1 1   14   35    1 o 63.88804 1.482707   56.86595   168.2   40.95826 1.894545          ?        ? 
1 1 1   14   35    2 o 66.90646 1.325923   65.40824   207.0   44.89771 1.774257          ?        ? 
1 1 1   14   35    3 o 71.37427 1.221858   85.09358    15.5   51.09257 1.744184          ?        ? 
1 1 1   14   35    4 o 14.33359 3.658623   15.96513   316.2   2.195267 1.052525          ?        ? 
1 1 1   14   35    5 o 80.56694 1.157096   73.04044   240.5   65.10619 1.864473          ?        ? 
1 1 1   14   35    6 o 19.44110 2.706959   28.30311    94.0   3.849235 1.052525          ?        ? 
1 1 1   14   35    7 o 42.27131 1.493957   36.78047   154.6   17.98314 1.263030          ?        ? 
1 1 1   14   35    8 o 36.70815 1.638445   41.02531   279.8   13.59261 1.202886          ?        ? 
1 1 1   14   35    9 o 31.96501 1.834527   21.30634   296.5   10.34482 1.172814          ?        ? 
1 1 1   14   35   10 o 6.954442 3.231101   2.872288    29.3 -0.8420200 1.082597          ?        ? 
1 1 1   14   35   11 o 23.89596 2.391077   28.99502    77.7   5.894140 1.142741          ?        ? 
1 1 1   14   35   12 o 26.63350 2.032398   14.19874    60.5   7.277459 1.082597          ?        ? 
1 1 1   14   35   13 o 7.392282 3.371246   4.253528    90.1 -0.5112265 1.112669          ?        ? 
1 1 1   14   35   14 o 11.02158 4.242880   9.031881   234.5   1.232958 1.323174          ?        ? 
1 1 1   14   35   15 o 22.33820 2.827064   21.24247   312.0   5.503202 1.263030          ?        ? 
1 1 1   14   36    0 o 11.38969 5.936080   15.52572   180.0   1.984761 1.744184   1.984761 1.744184 
1 1 1   14   36    1 o 15.85739 4.199626   10.33652    14.2   2.706493 1.353247          ?        ? 
1 1 1   14   36    2 o 72.32024 1.413785   73.44258   310.9   52.53604 2.044906          ?        ? 
1 1 1   14   36    3 o 58.33741 1.288716   67.49078   318.2   34.16196 1.503607          ?        ? 
1 1 1   14   36    4 o 63.07964 1.215669   58.63501    45.6   39.93581 1.533679          ?        ? 
1 1 1   14   36    5 o 37.59402 1.519845   20.31893   257.9   14.22412 1.142741          ?        ? 
1 1 1   14   36    6 o 28.84169 2.033191   33.76210    63.4   8.420200 1.172814          ?        ? 
1 1 1   14   36    7 o 45.22148 1.462993   44.92242   219.1   20.59942 1.323174          ?        ? 
1 1 1   14   36    8 o 29.45567 2.041858   29.01768   287.9   8.811138 1.202886          ?        ? 
1 1 1   14   36    9 o 40.74535 1.476102   42.46484    58.6   16.78026 1.202886          ?        ? 
1 1 1   14   36   10 o 20.02789 2.777800   20.14651   101.3   4.180028 1.112669          ?        ? 
1 1 1   14   36   11 o 45.61753 1.450292   35.58430    26.9   21.08057 1.323174          ?        ? 
1 1 1   14   36   12 o 28.46634 2.271283   23.76293   245.0   8.420200 1.293102          ?        ? 
1 1 1   14   36   13 o 13.65355 3.887167   8.209248   143.4   2.195267 1.112669          ?        ? 
1 1 1   14   36   14 o 9.467060 3.991444   2.431802   324.5  0.5713707 1.293102          ?        ? 
1 1 1   14   37    0 o 17.43993 5.964652   17.53120   180.0   4.059740 1.864473   4.059740 1.864473 
1 1 1   14   37    1 o 28.72737 2.512348   27.48989   286.1   8.390128 1.443463          ?        ? 
1 1 1   14   37    2 o 48.41368 1.614989   50.07913   292.9   23.60663 1.563751          ?        ? 
1 1 1   14   37    3 o 37.61803 1.598816   19.92513    46.2   14.25420 1.202886          ?        ? 
1 1 1   14   37    4 o 16.22064 3.528249   20.09827   340.5   2.826782 1.112669          ?        ? 
1 1 1   14   37    5 o 14.81006 3.669126   16.16930   159.6   2.375700 1.082597          ?        ? 
1 1 1   14   37    6 o 15.30661 3.755922   11.09172   309.6   2.556132 1.142741          ?        ? 
1 1 1   14   37    7 f 31.80160 1.891235   41.82067   143.9   10.25460 1.202886          ?        ? 
1 1 1   14   37    8 o 26.79841 2.075999   25.71209    34.5   7.337603 1.112669          ?        ? 
1 1 1   14   37    9 o 23.98852 2.319171   16.02711   186.0   5.924213 1.112669          ?        ? 
1 1 1   14   37   10 o 13.38963 3.911756   11.02777   266.4   2.014834 1.112669          ?        ? 
1 1 1   14   37   11 o 13.28479 3.985892   25.86170   307.8   2.014834 1.142741          ?        ? 
1 1 1   14   37   12 o 9.292234 3.822501   2.872049   345.4  0.5412986 1.142741          ?        ? 
1 1 1   14   37   13 o 20.30697 3.035800   19.44427   256.9   4.570966 1.232958          ?        ? 
1 1 1   14   38    0 o 74.28440 1.925784   78.55632     0.0   55.60339 2.856854   55.60339 2.856854 
1 1 1   14   38    1 o 43.43822 1.696128   39.37579   173.9   19.03567 1.473535          ?        ? 
1 1 1   14   38    2 o 48.60328 1.608690   43.44462   233.9   23.81714 1.563751          ?        ? 
1 1 1   14   38    3 o 37.81479 1.670022   27.60240   164.2   14.43463 1.263030          ?        ? 
1 1 1   14   38    4 o 27.78014 2.165010   14.86744   273.2   7.848830 1.202886          ?        ? 
1 1 1   14   38    5 f 51.82312 1.334654   41.76717   304.0   27.03486 1.383319          ?        ? 
1 1 1   14   38    6 o 18.88827 3.386565   17.26211   333.2   3.849235 1.232958          ?        ? 
1 1 1   14   38    7 o 27.53429 2.129733   21.02558   238.0   7.758613 1.172814          ?        ? 
1 1 1   14   38    8 o 34.23537 1.800708   28.84081   217.6   11.93864 1.232958          ?        ? 
1 1 1   14   38    9 o 8.577947 3.688947   16.08016   231.2       0.09 1.142741          ?        ? 
1 1 1   14   38   10 o 18.19508 3.682100   13.74292    98.9   3.728946 1.293102          ?        ? 
1 1 1   14   38   11 o 16.61005 3.714838   18.50492   301.7   3.187647 1.202886          ?        ? 
1 1 1   14   38   12 o 14.85338 4.042922   22.30300   129.5   2.706493 1.232958          ?        ? 
1 1 1   14   38   13 o 11.04969 4.052739   11.22580   259.3   1.413391 1.172814          ?        ? 
1 1 1   14   39    0 o 45.48022 2.327168   32.68343   180.0   21.05050 2.105050   21.05050 2.105050 
1 1 1   14   39    1 o 35.76450 2.060053   35.88091   354.5   12.99117 1.473535          ?        ? 
1 1 1   14   39    2 o 26.18865 2.411407   27.85430   118.3   7.006810 1.263030          ?        ? 
1 1 1   14   39    3 o 33.51614 1.929074   28.73202   273.0   11.39734 1.293102          ?        ? 
1 1 1   14   39    4 o 44.90044 1.473454   36.80558   240.8   20.35884 1.323174          ?        ? 
1 1 1   14   39    5 o 24.33240 2.471778   20.97322    41.7   6.104645 1.202886          ?        ? 
1 1 1   14   39    6 o 35.24256 1.919904   35.47440   113.8   12.66037 1.353247          ?        ? 
1 1 1   14   39    7 o 12.66179 4.022018   8.816062    38.8   1.774257 1.142741          ?        ? 
1 1 1   14   39    8 o 21.41483 2.808535   23.26178   305.8   4.811543 1.202886          ?        ? 
1 1 1   14   39    9 o 24.66343 2.438602   23.15614   305.8   6.345222 1.202886          ?        ? 
1 1 1   14   39   10 o 11.04176 4.052456   4.660718   209.8   1.263030 1.172814          ?        ? 
1 1 1   14   39   11 o 28.82330 2.138822   28.52299   100.4   8.720922 1.232958          ?        ? 
1 1 1   14   39   12 o 24.13927 2.491554   32.96841   152.2   6.285078 1.202886          ?        ? 
1 1 1   14   40    0 f 41.23337 2.573269   42.65010     0.0   17.47192 2.105050   17.47192 2.105050 
1 1 1   14   40    1 o 67.64553 1.378120   62.20629   294.0   46.19081 1.864473          ?        ? 
1 1 1   14   40    2 o 29.67765 2.026586   16.49420     5.6   8.991571 1.202886          ?        ? 
1 1 1   14   40    3 o 24.52998 2.390573   25.97104   189.5   6.194862 1.172814          ?        ? 
1 1 1   14   40    4 o 16.12782 3.710803   5.062668   349.0   2.886926 1.172814          ?        ? 
1 1 1   14   40    5 o 26.53243 2.380163   31.47914    12.3   7.277459 1.263030          ?        ? 
1 1 1   14   40    6 o 20.16660 2.833253   14.02967   193.6   4.270245 1.142741          ?        ? 
1 1 1   14   40    7 o 41.16761 1.607058   31.49171   139.3   17.23134 1.323174          ?        ? 
1 1 1   14   40    8 o 30.55006 2.214802   31.63045   136.6   9.683230 1.353247          ?        ? 
1 1 1   14   40    9 o 33.36945 1.892495   31.23559    30.2   11.48756 1.263030          ?        ? 
1 1 1   14   40   10 o 21.09189 2.851536   23.05547   102.2   4.841615 1.202886          ?        ? 
1 1 1   14   40   11 o 23.17685 2.789642   19.99679   133.1   5.894140 1.293102          ?        ? 
1 1 1   14   41    0 o 11.63773 6.256176   3.732121   180.0   2.225339 1.984761   2.225339 1.984761 
1 1 1   14   41    1 o 55.61457 1.568100   49.89528   100.4   31.36525 1.744184          ?        ? 
1 1 1   14   41    2 o 8.576592 3.737503   10.29408   321.8      -0.03 1.202886          ?        ? 
1 1 1   14   41    3 o 13.99800 4.126851   3.383023   174.1   2.225339 1.232958          ?        ? 
1 1 1   14   41    4 o 28.80811 2.296531   32.16220   131.7   8.570561 1.323174          ?        ? 
1 1 1   14   41    5 o 48.60030 1.454097   31.24705   351.1   23.93743 1.413391          ?        ? 
1 1 1   14   41    6 o 16.31577 3.838271   12.58344    44.8   3.037287 1.232958          ?        ? 
1 1 1   14   41    7 o 29.81033 2.068004   21.66623   305.2   9.202076 1.232958          ?        ? 
1 1 1   14   41    8 f 27.85505 2.267147   24.62889   258.8   8.119479 1.263030          ?        ? 
1 1 1   14   41    9 o 10.71069 4.067247   18.35363    21.8   1.202886 1.202886          ?        ? 
1 1 1   14   41   10 o 25.70687 2.573581   23.01268    89.0   7.157170 1.323174          ?        ? 
1 1 1   14   42    0 o 29.78300 3.515503   24.35328   180.0   9.562942 2.044906   9.562942 2.044906 
1 1 1   14   42    1 o 13.03791 4.565882   12.96704   206.4   1.834401 1.473535          ?        ? 
1 1 1   14   42    2 o 10.20838 4.019336   14.34474    20.9  0.8119479 1.202886          ?        ? 
1 1 1   14   42    3 o 19.69315 3.054072   7.239779   282.0   4.119884 1.202886          ?        ? 
1 1 1   14   42    4 o 27.24820 2.262457   16.10886   302.8   7.698469 1.232958          ?        ? 
1 1 1   14   42    5 o 14.42980 4.020462   17.25658   163.3   2.435844 1.202886          ?        ? 
1 1 1   14   42    6 o 26.00635 2.370494   22.23812   251.6   7.097026 1.232958          ?        ? 
1 1 1   14   42    7 o 16.23543 3.926937   15.67803   195.2   3.127503 1.263030          ?        ? 
1 1 1   14   42    8 o 24.77709 2.488101   21.34213   301.4   6.585800 1.232958          ?        ? 
1 1 1   14   42    9 o 11.88818 4.265695   6.684988   118.8   1.714112 1.293102          ?        ? 
1 1 1   14   43    0 o 8.484862 5.482402   3.313594   180.0  0.5112265 2.105050  0.5112265 2.105050 
1 1 1   14   43    1 o 34.05304 2.163588   33.05317   267.6   12.02886 1.473535          ?        ? 
1 1 1   14   43    2 o 31.52200 2.146511   20.56781    65.3   10.31474 1.353247          ?        ? 
1 1 1   14   43    3 o 11.51182 4.161866   13.73629    74.4   1.413391 1.232958          ?        ? 
1 1 1   14   43    4 o 31.58128 2.047261   29.48583   301.9   10.34482 1.293102          ?        ? 
1 1 1   14   43    5 o 19.20130 3.132303   15.88692   216.0   4.029667 1.202886          ?        ? 
1 1 1   14   43    6 o 14.15249 4.112369   13.03022    18.8   2.465916 1.232958          ?        ? 
1 1 1   14   43    7 o 22.87156 2.761136   14.56569   348.3   5.713707 1.263030          ?        ? 
1 1 1   14   44    0 o 10.72439 6.164267   1.302606   180.0   1.984761 2.074978   1.984761 2.074978 
1 1 1   14   44    1 o 8.720403 3.928212   3.622222   356.0 -0.2706493 1.443463          ?        ? 
1 1 1   14   44    2 o 21.73530 2.905481   23.23041   228.3   5.112265 1.263030          ?        ? 
1 1 1   14   44    3 o 7.499614 3.470452   4.749511    34.0 -0.6615872 1.232958          ?        ? 
1 1 1   14   44    4 o 19.57150 3.149882   17.70070   191.6   4.270245 1.232958          ?        ? 
1 1 1   14   44    5 o 11.15951 4.103261   13.60203   278.8   1.413391 1.202886          ?        ? 
1 1 1   14   44    6 o 10.41996 4.146799   15.35618    29.0   1.082597 1.293102          ?        ? 
1 1 1   14   45    0 o 12.91270 6.712037  0.9498019   180.0   3.187647 2.225339   3.187647 2.225339 
1 1 1   14   45    1 o 20.43206 3.745637   18.07164   130.5   4.961904 1.473535          ?        ? 
1 1 1   14   45    2 o 12.40577 4.372493   9.585429   289.8   1.894545 1.353247          ?        ? 
1 1 1   14   45    3 o 8.954740 3.815573   9.852117   160.7  0.4210100 1.202886          ?        ? 
1 1 1   14   45    4 o 8.435829 3.782059   10.26813    12.9      -0.06 1.323174          ?        ? 
1 1 1   15    0    1 o 114.6890 1.350782   99.73692    90.0   131.5957 3.097431   131.5957 3.097431 
1 1 1   15    0    2 o 386.3045 3.312882   431.1910   270.0   1493.022 25.59139   1493.022 25.59139 
1 1 1   15    0    3 f 97.45880 1.188362   150.6396   270.0   95.02798 2.315555   95.02798 2.315555 
1 1 1   15    0    4 f 230.0862 2.117734   184.1330   270.0   529.6005 9.743376   529.6005 9.743376 
1 1 1   15    0    5 o 18.65866 1.803908   60.88141   270.0   3.578585 0.6615872   3.578585 0.6615872 
1 1 1   15    0    6 o 182.8957 1.726780   274.5078   270.0   334.6429 6.315150   334.6429 6.315150 
1 1 1   15    0    7 o 158.9324 1.532949   244.5708    90.0   252.6962 4.871688   252.6962 4.871688 
1 1 1   15    0    8 o 130.0665 1.572716   163.7748    90.0   169.2761 4.089812   169.2761 4.089812 
1 1 1   15    0    9 o 265.2477 2.715942   312.9773    90.0   704.2595 14.40456   704.2595 14.40456 
1 1 1   15    0   10 f 18.39387 1.575311   49.59559    90.0   3.458297 0.5713707   3.458297 0.5713707 
1 1 1   15    0   11 o 84.09320 1.019510   100.6651   270.0   70.75976 1.714112   70.75976 1.714112 
1 1 1   15    0   12 o 70.28468 0.9845154   116.5812   270.0   49.43860 1.383319   49.43860 1.383319 
1 1 1   15    0   13 o 191.9586 1.809779   257.4843    90.0   368.8649 6.946666   368.8649 6.946666 
1 1 1   15    0   14 o 23.77027 1.726128   23.73810    90.0   5.743780 0.8119479   5.743780 0.8119479 
1 1 1   15    0   15 o 105.9860 1.277232   170.9437    90.0   112.4398 2.706493   112.4398 2.706493 
1 1 1   15    0   16 o 64.83975 1.090600   70.61947   270.0   42.10100 1.413391   42.10100 1.413391 
1 1 1   15    0   17 o 139.1783 2.010383   147.1794    90.0   194.2961 5.593419   194.2961 5.593419 
1 1 1   15    0   18 o 59.90987 1.558401   71.34790    90.0   36.05650 1.864473   36.05650 1.864473 
1 1 1   15    0   19 o 12.92363 4.783336   3.528002   270.0   2.285483 1.142741   2.285483 1.142741 
1 1 1   15    0   20 o 27.75807 1.970022   15.96590   270.0   7.878902 1.082597   7.878902 1.082597 
1 1 1   15    0   21 o 9.776456 4.755875   1.774428    90.0   1.503607 1.082597   1.503607 1.082597 
1 1 1   15    0   22 o 31.60982 1.917322   33.75465    90.0   10.25460 1.202886   10.25460 1.202886 
1 1 1   15    0   23 o 6.854731 4.377268   3.172003   270.0  0.4210100 1.293102  0.4210100 1.293102 
1 1 1   15    1    0 o 122.3224 1.463237   67.89744   180.0   149.6991 3.578585   149.6991 3.578585 
1 1 1   15    1    1 o 119.4135 0.9947369   96.45420   232.1   142.6021 2.375700          ?        ? 
1 1 1   15    1    2 o 331.9937 2.051648   366.9903   129.5   1102.415 13.62268          ?        ? 
1 1 1   15    1    3 o 134.7353 1.004374   128.2713   165.4   181.5455 2.706493          ?        ? 
1 1 1   15    1    4 o 142.5111 1.044530   181.6845   170.8   203.1073 2.977142          ?        ? 
1 1 1   15    1    5 o 145.5894 1.053428   265.5439    14.1   211.9786 3.067359          ?        ? 
1 1 1   15    1    6 o 93.20573 0.8227388   39.37083   270.7   86.87843 1.533679          ?        ? 
1 1 1   15    1    7 o 134.2725 1.075025   172.4266    47.8   180.3126 2.886926          ?        ? 
1 1 1   15    1    8 o 202.2293 1.531643   297.8958   278.8   409.1015 6.194862          ?        ? 
1 1 1   15    1    9 o 66.30384 0.6576484   50.44058   285.7   43.96547 0.8720922          ?        ? 
1 1 1   15    1   10 o 170.8138 1.205958   232.1117   182.7   291.8802 4.119884          ?        ? 
1 1 1   15    1   11 o 73.21896 0.6982161   99.54210   166.4   53.61863 1.022453          ?        ? 
1 1 1   15    1   12 o 42.82542 0.7022031   59.13795   301.4   18.34401 0.6014429          ?        ? 
1 1 1   15    1   13 o 74.05199 0.7512759   96.23455    69.0   54.85159 1.112669          ?        ? 
1 1 1   15    1   14 o 45.80447 0.9191462   68.91669    46.8   20.99036 0.8420200          ?        ? 
1 1 1   15    1   15 o 78.42353 0.7860893   101.5628   348.6   61.52761 1.232958          ?        ? 
1 1 1   15    1   16 o 111.2489 0.9460996   125.9989   127.6   123.8672 2.105050          ?        ? 
1 1 1   15    1   17 o 29.55341 1.271941   31.19993   299.2   8.750995 0.7518036          ?        ? 
1 1 1   15    1   18 o 43.61488 1.034239   36.41059   208.1   19.06574 0.9021643          ?        ? 
1 1 1   15    1   19 o 25.28799 1.486483   25.84596   162.2   6.435439 0.7518036          ?        ? 
1 1 1   15    1   20 o 39.02713 1.117290   45.91157   251.7   15.30672 0.8720922          ?        ? 
1 1 1   15    1   21 o 37.18339 1.213128   43.24689    41.5   13.95348 0.9021643          ?        ? 
1 1 1   15    1   22 o 11.36320 3.093329   13.83589   142.7   1.443463 0.7217315          ?        ? 
1 1 1   15    1   23 o 35.13741 1.369351   36.87377   206.2   12.63030 0.9623086          ?        ? 
1 1 1   15    2    0 o 421.7148 3.594570   577.0523     0.0   1779.339 30.31272   1779.339 30.31272 
1 1 1   15    2    1 o 343.2957 2.154920   399.2131    30.6   1178.768 14.79550          ?        ? 
1 1 1   15    2    2 o 165.9373 1.196091   135.4109    18.3   275.3706 3.969523          ?        ? 
1 1 1   15    2    3 o 186.3770 1.274674   169.8839    84.5   347.3934 4.751399          ?        ? 
1 1 1   15    2    4 o 180.5916 1.232250   188.9511   128.9   326.1625 4.450677          ?        ? 
1 1 1   15    2    5 o 106.7414 0.8733594   240.1387   344.2   113.9434 1.864473          ?        ? 
1 1 1   15    2    6 o 257.1706 1.619544   363.3835   210.9   661.5270 8.329985          ?        ? 
1 1 1   15    2    7 f 166.6677 1.380303   184.8681   350.7   277.8365 4.601038          ?        ? 
1 1 1   15    2    8 o 189.9569 1.519779   195.7354   345.0   360.9560 5.773852          ?        ? 
1 1 1   15    2    9 o 157.3263 1.471817   169.9401   336.9   247.6140 4.631110          ?        ? 
1 1 1   15    2   10 o 50.49095 1.101850   59.50906    75.3   25.50118 1.112669          ?        ? 
1 1 1   15    2   11 o 84.00378 0.7517698   87.74808   336.2   70.57932 1.263030          ?        ? 
1 1 1   15    2   12 o 42.57942 0.6709471   46.06588    65.9   18.13350 0.5713707          ?        ? 
1 1 1   15    2   13 o 26.12145 0.9785569   26.78256   146.1   6.826377 0.5112265          ?        ? 
1 1 1   15    2   14 o 113.8362 1.083098   145.8330   306.2   129.6711 2.465916          ?        ? 
1 1 1   15    2   15 o 61.98056 0.8005580   98.85978   347.2   38.43220 0.9923807          ?        ? 
1 1 1   15    2   16 o 72.43243 0.9133853   67.79349   181.7   52.50597 1.323174          ?        ? 
1 1 1   15    2   17 o 46.44231 0.9388983   56.67241   349.4   21.59180 0.8720922          ?        ? 
1 1 1   15    2   18 o 66.00816 1.002281   81.38593   263.8   43.66475 1.323174          ?        ? 
1 1 1   15    2   19 o 16.51995 2.184425   11.24904   192.9   2.766637 0.7217315          ?        ? 
1 1 1   15    2   20 o 30.52218 1.330095   30.43839   316.8   9.382509 0.8119479          ?        ? 
1 1 1   15    2   21 o 16.88524 2.315263   20.98580   273.5   2.947070 0.7818757          ?        ? 
1 1 1   15    2   22 o 7.642381 3.189234   8.136956    92.4  0.2405772 0.8119479          ?        ? 
1 1 1   15    2   23 o 7.856670 3.225362   9.378768     8.6  0.3909379 0.8119479          ?        ? 
1 1 1   15    3    0 o 206.4093 2.215089   279.2477     0.0   426.2426 9.141932   426.2426 9.141932 
1 1 1   15    3    1 o 284.8136 1.853023   309.5680   107.6   811.3163 10.55532          ?        ? 
1 1 1   15    3    2 o 317.6611 1.997482   371.9656   273.4   1009.281 12.69044          ?        ? 
1 1 1   15    3    3 o 149.4227 1.086780   278.7596   357.3   223.2857 3.247792          ?        ? 
1 1 1   15    3    4 o 259.8666 1.672175   288.0335   208.6   675.4203 8.690849          ?        ? 
1 1 1   15    3    5 o 267.6876 1.673873   280.5674   184.3   716.7094 8.961499          ?        ? 
1 1 1   15    3    6 o 265.4819 1.999283   315.9014   242.6   705.0715 10.61547          ?        ? 
1 1 1   15    3    7 o 33.35388 1.262252   28.40579   340.3   11.12669 0.8420200          ?        ? 
1 1 1   15    3    8 o 66.27992 0.8847428   151.3231   149.1   43.93541 1.172814          ?        ? 
1 1 1   15    3    9 o 86.12285 1.099909   118.2877    14.3   74.18798 1.894545          ?        ? 
1 1 1   15    3   10 o 112.4165 1.230529   149.9228    33.4   126.4233 2.766637          ?        ? 
1 1 1   15    3   11 o 107.1388 1.249043   164.9951     0.6   114.8455 2.676421          ?        ? 
1 1 1   15    3   12 o 34.11089 0.7052798   55.01468    79.0   11.63792 0.4811543          ?        ? 
1 1 1   15    3   13 o 39.04143 0.7702624   68.45893    55.0   15.24658 0.6014429          ?        ? 
1 1 1   15    3   14 o 23.70440 1.205200   26.97866   131.8   5.623491 0.5713707          ?        ? 
1 1 1   15    3   15 o 76.44276 0.8064584   73.80535   133.0   58.46025 1.232958          ?        ? 
1 1 1   15    3   16 o 51.04227 0.8837423   56.76284    48.3   26.07255 0.9021643          ?        ? 
1 1 1   15    3   17 o 46.18223 0.9441860   63.74986   178.1   21.35122 0.8720922          ?        ? 
1 1 1   15    3   18 o 45.36411 1.060650   37.49266   116.7   20.62949 0.9623086          ?        ? 
1 1 1   15    3   19 o 9.813222 3.202799   4.701092   334.0  0.9623086 0.7217315          ?        ? 
1 1 1   15    3   20 o 30.35377 1.436547   36.06966   254.6   9.292293 0.8720922          ?        ? 
1 1 1   15    3   21 o 16.06345 2.433711   20.40948   215.9   2.676421 0.7818757          ?        ? 
1 1 1   15    3   22 o 35.41050 1.401252   41.76519   295.8   12.75059 0.9923807          ?        ? 
1 1 1   15    3   23 o 22.99519 2.157801   21.36567     8.7   5.593419 0.9923807          ?        ? 
1 1 1   15    4    0 o 28.43019 1.489500   9.529705   360.0   8.149551 0.8420200   8.149551 0.8420200 
1 1 1   15    4    1 o 333.3501 2.147043   288.2627   139.5   1111.466 14.31434          ?        ? 
1 1 1   15    4    2 o 199.9809 1.338339   310.8575    88.8   399.9595 5.352841          ?        ? 
1 1 1   15    4    3 f 200.7746 1.377982   333.7695     2.0   403.1472 5.533275          ?        ? 
1 1 1   15    4    4 o 359.8067 2.369454   343.6449   286.3   1295.057 17.05091          ?        ? 
1 1 1   15    4    5 o 300.2560 1.983069   334.9951   303.2   901.8035 11.90857          ?        ? 
1 1 1   15    4    6 o 118.7898 1.164510   183.1458   202.9   141.1286 2.766637          ?        ? 
1 1 1   15    4    7 o 283.4310 2.079568   268.3020    99.7   803.7082 11.78828          ?        ? 
1 1 1   15    4    8 o 180.7192 1.464343   163.9694   258.9   326.7038 5.292697          ?        ? 
1 1 1   15    4    9 o 115.8335 1.233172   129.2456   263.8   134.2120 2.856854          ?        ? 
1 1 1   15    4   10 o 100.1114 1.216566   98.69444    23.1   100.2605 2.435844          ?        ? 
1 1 1   15    4   11 f 60.46009 1.069385   72.06231   151.8   36.56773 1.293102          ?        ? 
1 1 1   15    4   12 o 36.36178 1.364593   37.98970   163.5   13.23174 0.9923807          ?        ? 
1 1 1   15    4   13 o 30.17946 0.9466218   40.57014    94.7   9.111859 0.5713707          ?        ? 
1 1 1   15    4   14 o 76.66231 0.7845354   104.2875   180.9   58.79104 1.202886          ?        ? 
1 1 1   15    4   15 o 34.32233 1.007594   41.35153   179.0   11.78828 0.6916593          ?        ? 
1 1 1   15    4   16 o 69.29294 0.9330693   73.76748   227.5   48.05529 1.293102          ?        ? 
1 1 1   15    4   17 f 70.31605 0.9408766   62.54360   260.9   49.49875 1.323174          ?        ? 
1 1 1   15    4   18 o 20.23235 1.709291   28.11548   164.2   4.119884 0.6916593          ?        ? 
1 1 1   15    4   19 o 49.67772 1.180422   57.86157   144.3   24.77945 1.172814          ?        ? 
1 1 1   15    4   20 o 23.86995 2.078724   23.17478     7.7   5.803924 0.9923807          ?        ? 
1 1 1   15    4   21 o 8.470137 3.499300   12.25429   331.0  0.3307936 0.9623086          ?        ? 
1 1 1   15    4   22 o 8.148579 3.439783   6.972312   132.1  0.2405772 0.9623086          ?        ? 
1 1 1   15    4   23 o 24.60680 2.566425   29.55236    75.9   6.555727 1.263030          ?        ? 
1 1 1   15    5    0 o 334.5211 2.989582   311.2300     0.0   1119.556 19.99798   1119.556 19.99798 
1 1 1   15    5    1 o 437.1997 2.655045   489.7977   310.2   1912.107 23.21569          ?        ? 
1 1 1   15    5    2 o 92.54295 0.8773742   47.67606   253.5   85.64546 1.623896          ?        ? 
1 1 1   15    5    3 o 394.2332 2.559197   461.2374    51.0   1554.790 20.17841          ?        ? 
1 1 1   15    5    4 o 303.2497 2.032909   404.7537   108.7   919.8468 12.32958          ?        ? 
1 1 1   15    5    5 o 135.6771 1.130389   143.1586   287.7   184.1017 3.067359          ?        ? 
1 1 1   15    5    6 o 184.6454 1.530925   221.1353   199.1   341.0181 5.653563          ?        ? 
1 1 1   15    5    7 o 267.2880 2.013901   321.7429   153.4   714.7548 10.76583          ?        ? 
1 1 1   15    5    8 o 118.1115 1.171198   168.5049   170.8   139.5347 2.766637          ?        ? 
1 1 1   15    5    9 o 142.1759 1.300809   170.0153   220.7   202.2051 3.698874          ?        ? 
1 1 1   15    5   10 o 124.7806 1.349601   168.7456   301.3   155.7737 3.368080          ?        ? 
1 1 1   15    5   11 o 45.04303 1.235118   31.59376   294.5   20.29870 1.112669          ?        ? 
1 1 1   15    5   12 o 70.91159 1.145014   107.8980   218.2   50.31070 1.623896          ?        ? 
1 1 1   15    5   13 o 36.78106 0.7767186   47.47548   218.8   13.53246 0.5713707          ?        ? 
1 1 1   15    5   14 o 57.97358 0.7780824   89.20349   285.9   33.62066 0.9021643          ?        ? 
1 1 1   15    5   15 o 24.26233 1.363404   18.05845    91.7   5.894140 0.6615872          ?        ? 
1 1 1   15    5   16 o 31.19252 1.205102   32.31692   267.1   9.743376 0.7518036          ?        ? 
1 1 1   15    5   17 o 49.77407 1.027094   67.63979   273.0   24.80952 1.022453          ?        ? 
1 1 1   15    5   18 o 35.15428 1.497008   43.35767   315.4   12.41980 1.052525          ?        ? 
1 1 1   15    5   19 o 54.88376 1.205433   62.24077   287.4   30.25258 1.323174          ?        ? 
1 1 1   15    5   20 o 31.26514 1.635132   40.23572   109.0   9.893736 1.022453          ?        ? 
1 1 1   15    5   21 o 33.21820 1.629524   37.41716    18.5   11.21691 1.082597          ?        ? 
1 1 1   15    5   22 o 21.23343 2.478463   24.91982    68.1   4.751399 1.052525          ?        ? 
1 1 1   15    5   23 o 14.73988 3.984977   17.65010   139.1   2.706493 1.202886          ?        ? 
1 1 1   15    6    0 o 88.01736 1.316055   139.5338    -0.0   77.52599 2.315555   77.52599 2.315555 
1 1 1   15    6    1 f 92.86656 1.036227   255.6592    66.6   86.24691 1.924617          ?        ? 
1 1 1   15    6    2 o 291.4042 2.012349   214.4638   317.2   849.3576 11.72814          ?        ? 
1 1 1   15    6    3 o 236.9096 1.675543   350.5880   260.7   561.3567 7.939046          ?        ? 
1 1 1   15    6    4 o 329.7441 2.229801   323.5515   177.5   1087.679 14.70528          ?        ? 
1 1 1   15    6    5 o 195.5245 1.438053   247.2359   177.3   382.3673 5.623491          ?        ? 
1 1 1   15    6    6 o 143.2088 1.291427   153.8644    35.3   205.1221 3.698874          ?        ? 
1 1 1   15    6    7 o 200.5956 1.641562   275.7111   297.7   402.5157 6.585800          ?        ? 
1 1 1   15    6    8 f 54.66813 1.045163   124.0638   134.0   29.89171 1.142741          ?        ? 
1 1 1   15    6    9 o 164.3161 1.418358   158.8931   235.1   270.1080 4.661182          ?        ? 
1 1 1   15    6   10 o 131.8751 1.391014   197.7515   328.4   173.9974 3.668802          ?        ? 
1 1 1   15    6   11 o 49.85819 1.176149   78.34975    60.6   24.86966 1.172814          ?        ? 
1 1 1   15    6   12 o 161.1047 1.791957   208.3146    92.9   259.8835 5.773852          ?        ? 
1 1 1   15    6   13 o 84.65756 0.7814862   117.6296   247.7   71.69199 1.323174          ?        ? 
1 1 1   15    6   14 o 118.9238 1.062049   147.4799    60.8   141.5195 2.526060          ?        ? 
1 1 1   15    6   15 f 77.62674 0.9103763   85.67677    68.8   60.29465 1.413391          ?        ? 
1 1 1   15    6   16 o 62.08363 1.017200   69.83896   161.0   38.58256 1.263030          ?        ? 
1 1 1   15    6   17 o 84.00002 1.038205   101.2355   212.5   70.66954 1.744184          ?        ? 
1 1 1   15    6   18 o 26.13732 1.898398   35.48610   193.3   6.886521 0.9923807          ?        ? 
1 1 1   15    6   19 o 48.50375 1.239992   62.95181   346.1   23.63671 1.202886          ?        ? 
1 1 1   15    6   20 o 7.399842 3.342701   8.370059    14.7 -0.4510822 1.052525          ?        ? 
1 1 1   15    6   21 o 7.503078 3.324436   16.84844   118.2 -0.2105050 0.9923807          ?        ? 
1 1 1   15    6   22 o 18.58558 2.993367   20.73832   108.4   3.728946 1.112669          ?        ? 
1 1 1   15    6   23 o 17.64785 3.445735   14.00799   320.3   3.668802 1.172814          ?        ? 
1 1 1   15    7    0 o 422.1274 4.314564   500.0305    -0.0   1783.398 36.41737   1783.398 36.41737 
1 1 1   15    7    1 f 146.7088 1.332360   143.6361   295.0   215.2564 3.909379          ?        ? 
1 1 1   15    7    2 o 295.9276 2.281368   320.8663   227.0   876.0016 13.50239          ?        ? 
1 1 1   15    7    3 o 73.26365 0.9645922   19.33877    40.8   53.67878 1.413391          ?        ? 
1 1 1   15    7    4 o 29.32518 1.230566   20.58797   307.1   8.600634 0.7217315          ?        ? 
1 1 1   15    7    5 o 139.5546 1.109756   179.4214   208.3   194.7773 3.097431          ?        ? 
1 1 1   15    7    6 o 32.06598 1.500513   91.13300   238.1   10.28467 0.9623086          ?        ? 
1 1 1   15    7    7 o 171.1611 1.546116   205.4105   302.5   293.0530 5.292697          ?        ? 
1 1 1   15    7    8 o 28.80277 1.618311   72.89449    24.5   8.299912 0.9322364          ?        ? 
1 1 1   15    7    9 o 61.67006 1.048404   109.8206    83.8   38.04126 1.293102          ?        ? 
1 1 1   15    7   10 o 62.34184 1.302413   93.09892   239.9   38.88329 1.623896          ?        ? 
1 1 1   15    7   11 o 94.88923 1.331057   117.2277    88.0   90.09615 2.526060          ?        ? 
1 1 1   15    7   12 o 112.2984 1.379108   135.6258   192.8   126.2128 3.097431          ?        ? 
1 1 1   15    7   13 o 31.01435 0.8726584   47.89360    82.8   9.623086 0.5412986          ?        ? 
1 1 1   15    7   14 o 35.74095 0.9255312   66.84976   146.7   12.78066 0.6615872          ?        ? 
1 1 1   15    7   15 o 69.80547 1.163158   57.72685    23.7   48.77702 1.623896          ?        ? 
1 1 1   15    7   16 o 36.25454 1.451577   34.18575    80.5   13.17160 1.052525          ?        ? 
1 1 1   15    7   17 o 13.92098 3.197747   30.23402   345.9   2.044906 0.8720922          ?        ? 
1 1 1   15    7   18 o 44.24727 1.155385   54.99476   341.3   19.63711 1.022453          ?        ? 
1 1 1   15    7   19 o 12.56194 3.627557   13.64485   158.1   1.684040 0.9623086          ?        ? 
1 1 1   15    7   20 o 7.790498 3.441310   20.71800    70.2 -0.2105050 1.052525          ?        ? 
1 1 1   15    7   21 o 12.72958 3.891760   17.97798    55.2   1.804329 1.082597          ?        ? 
1 1 1   15    7   22 o 20.64256 2.695086   18.55899   242.8   4.540894 1.112669          ?        ? 
1 1 1   15    8    0 o 176.0482 2.110279   203.0392   180.0   310.1039 7.427820   310.1039 7.427820 
1 1 1   15    8    1 o 158.5959 1.336785   208.9859    18.9   251.5535 4.240172          ?        ? 
1 1 1   15    8    2 o 135.3118 1.200114   109.1162     1.7   183.1093 3.247792          ?        ? 
1 1 1   15    8    3 f 187.7529 1.497578   172.8713   356.2   352.5658 5.623491          ?        ? 
1 1 1   15    8    4 o 287.4619 2.113175   290.9908   126.7   826.6531 12.14915          ?        ? 
1 1 1   15    8    5 o 211.6893 1.520020   250.2101    11.9   448.2253 6.435439          ?        ? 
1 1 1   15    8    6 o 110.6518 1.087091   170.0866   311.1   122.4538 2.405771          ?        ? 
1 1 1   15    8    7 o 146.3049 1.407979   115.1543   101.9   214.1137 4.119884          ?        ? 
1 1 1   15    8    8 o 190.2935 1.706728   238.9724    47.2   362.3092 6.495584          ?        ? 
1 1 1   15    8    9 o 83.08047 1.140187   122.9850   120.7   69.04565 1.894545          ?        ? 
1 1 1   15    8   10 o 8.970153 3.608593   9.316530   228.5  0.3608657 0.9923807          ?        ? 
1 1 1   15    8   11 o 49.24422 1.374016   40.24784    22.0   24.26822 1.353247          ?        ? 
1 1 1   15    8   12 o 52.14570 1.355232   63.76381   165.8   27.21529 1.413391          ?        ? 
1 1 1   15    8   13 o 62.68465 0.6716318   73.13517   214.4   39.30429 0.8420200          ?        ? 
1 1 1   15    8   14 f 66.30640 1.043126   96.70907   201.8   43.99555 1.383319          ?        ? 
1 1 1   15    8   15 o 62.29832 1.182644   89.25856   220.9   38.85321 1.473535          ?        ? 
1 1 1   15    8   16 o 35.44734 1.611886   34.35833   124.9   12.60023 1.142741          ?        ? 
1 1 1   15    8   17 o 44.26297 1.222915   50.35460   139.7   19.63711 1.082597          ?        ? 
1 1 1   15    8   18 o 41.86675 1.256994   44.97151   192.3   17.59221 1.052525          ?        ? 
1 1 1   15    8   19 o 32.56977 1.661966   35.99008   139.0   10.70568 1.082597          ?        ? 
1 1 1   15    8   20 o 55.45142 1.274441   61.07525   338.8   31.00438 1.413391          ?        ? 
1 1 1   15    8   21 f 10.74070 3.990720   14.89755   200.0   1.082597 1.142741          ?        ? 
1 1 1   15    8   22 o 10.57233 3.978237   8.979869    68.3   1.112669 1.142741          ?        ? 
1 1 1   15    9    0 o 101.6286 1.495032   56.63296   180.0   103.3580 3.037287   103.3580 3.037287 
1 1 1   15    9    1 o 224.7184 1.833354   320.3212   104.2   505.0917 8.239767          ?        ? 
1 1 1   15    9    2 o 436.6682 3.116244   514.7333   144.0   1908.047 27.21529          ?        ? 
1 1 1   15    9    3 o 252.0159 1.927121   282.6105   194.3   635.3041 9.713303          ?        ? 
1 1 1   15    9    4 f 272.1729 1.933560   360.4046   299.1   741.0378 10.52525          ?        ? 
1 1 1   15    9    5 o 33.49014 0.9428372   61.78164   341.0   11.21691 0.6315150          ?        ? 
1 1 1   15    9    6 f 164.2245 1.263501   207.8295    67.9   269.7471 4.149956          ?        ? 
1 1 1   15    9    7 o 9.884692 3.614433   31.79558   122.3  0.7818757 0.9322364          ?        ? 
1 1 1   15    9    8 o 196.0520 1.786977   249.7486   227.2   384.5927 7.006810          ?        ? 
1 1 1   15    9    9 o 21.85702 1.857408   62.68850   155.7   4.781471 0.8119479          ?        ? 
1 1 1   15    9   10 o 101.2566 1.187958   130.6371   288.1   102.5761 2.405771          ?        ? 
1 1 1   15    9   11 o 82.19085 1.298881   117.5611   334.5   67.60218 2.135122          ?        ? 
1 1 1   15    9   12 o 60.47071 1.317848   57.79270    15.9   36.59780 1.593824          ?        ? 
1 1 1   15    9   13 o 116.3993 1.162590   139.1336    85.2   135.5953 2.706493          ?        ? 
1 1 1   15    9   14 o 50.89598 1.033996   95.85686   310.0   25.92219 1.052525          ?        ? 
1 1 1   15    9   15 o 81.51540 1.143632   85.39101   304.7   66.51958 1.864473          ?        ? 
1 1 1   15    9   16 o 31.30326 1.729209   25.26659   137.1   9.833591 1.082597          ?        ? 
1 1 1   15    9   17 f 46.39475 1.425996   50.31105   350.1   21.59180 1.323174          ?        ? 
1 1 1   15    9   18 o 28.86245 1.719155   41.40636   289.1   8.390128 0.9923807          ?        ? 
1 1 1   15    9   19 o 19.50059 2.390278   18.43894   266.5   3.879307 0.9322364          ?        ? 
1 1 1   15    9   20 o 6.376347 3.032955   8.643954   165.8  -1.202886 1.052525          ?        ? 
1 1 1   15    9   21 o 38.82524 1.626558   41.74419   108.4   15.33679 1.263030          ?        ? 
1 1 1   15    9   22 o 29.34750 1.844445   31.52480    24.8   8.901355 1.082597          ?        ? 
1 1 1   15   10    0 o 47.01282 1.410044   140.3728   180.0   22.16317 1.323174   22.16317 1.323174 
1 1 1   15   10    1 o 140.3909 1.381609   159.9640   114.7   197.1229 3.879307          ?        ? 
1 1 1   15   10    2 o 304.8826 2.308063   263.0045   117.4   929.9210 14.07376          ?        ? 
1 1 1   15   10    3 o 326.0862 2.513035   420.4509    96.5   1063.922 16.38932          ?        ? 
1 1 1   15   10    4 f 104.7339 1.019308   27.09555    56.8   109.7032 2.135122          ?        ? 
1 1 1   15   10    5 o 86.84164 0.8830323   66.88099    58.5   75.42094 1.533679          ?        ? 
1 1 1   15   10    6 o 163.8549 1.293880   248.5726    84.8   268.5443 4.240172          ?        ? 
1 1 1   15   10    7 o 56.66827 0.8490719   72.90145   189.9   32.11705 0.9623086          ?        ? 
1 1 1   15   10    8 o 77.54212 1.163451   76.72903   182.5   60.14429 1.804329          ?        ? 
1 1 1   15   10    9 o 76.34869 1.122555   139.0697    73.2   58.30989 1.714112          ?        ? 
1 1 1   15   10   10 o 32.70815 1.471053   25.65072    43.7   10.70568 0.9623086          ?        ? 
1 1 1   15   10   11 o 131.0503 1.606292   173.8226    59.2   171.9225 4.210100          ?        ? 
1 1 1   15   10   12 o 114.2286 1.408456   164.6649   352.1   130.6033 3.217719          ?        ? 
1 1 1   15   10   13 o 70.10242 0.9437438   92.87115   236.6   49.16796 1.323174          ?        ? 
1 1 1   15   10   14 o 15.85933 2.559844   10.09932   300.7   2.526060 0.8119479          ?        ? 
1 1 1   15   10   15 o 137.2292 1.391526   141.8347   344.6   188.6426 3.819162          ?        ? 
1 1 1   15   10   16 o 11.31784 3.867747   7.989309   123.4   1.202886 1.052525          ?        ? 
1 1 1   15   10   17 o 63.83559 1.319045   83.53159   231.1   40.86804 1.684040          ?        ? 
1 1 1   15   10   18 o 36.48679 1.689595   34.51477   332.5   13.41218 1.232958          ?        ? 
1 1 1   15   10   19 f 31.01242 1.648457   48.57499    34.7   9.713303 1.022453          ?        ? 
1 1 1   15   10   20 o 44.48475 1.419621   46.30864   177.0   19.99798 1.263030          ?        ? 
1 1 1   15   10   21 o 8.132439 3.493098   3.428361   317.1       0.09 1.022453          ?        ? 
1 1 1   15   10   22 o 24.61530 2.504455   26.04692   206.1   6.465511 1.232958          ?        ? 
1 1 1   15   11    0 o 160.4463 2.034328   204.0221   180.0   257.5980 6.525656   257.5980 6.525656 
1 1 1   15   11    1 o 274.7216 2.178335   295.2299    52.1   755.0213 11.96871          ?        ? 
1 1 1   15   11    2 o 194.1511 1.696050   205.0926     7.8   377.0446 6.585800          ?        ? 
1 1 1   15   11    3 o 39.99582 1.052635   64.08775    96.3   15.99838 0.8420200          ?        ? 
1 1 1   15   11    4 o 192.1647 1.650986   205.2983   208.3   369.3762 6.345222          ?        ? 
1 1 1   15   11    5 o 144.5431 1.352323   172.1721   256.6   208.9713 3.909379          ?        ? 
1 1 1   15   11    6 o 116.0845 1.139837   153.6429   289.1   134.7834 2.646349          ?        ? 
1 1 1   15   11    7 o 47.39189 0.9835401   42.16995   262.8   22.46389 0.9322364          ?        ? 
1 1 1   15   11    8 o 126.6450 1.412841   134.7861    39.5   160.4650 3.578585          ?        ? 
1 1 1   15   11    9 o 117.5184 1.407413   159.9258   239.2   138.1815 3.307936          ?        ? 
1 1 1   15   11   10 o 36.11440 1.415575   33.51718   354.7   13.05131 1.022453          ?        ? 
1 1 1   15   11   11 o 113.6240 1.495350   150.6741    77.8   129.2200 3.398152          ?        ? 
1 1 1   15   11   12 o 82.72723 1.036002   102.3914    98.9   68.47427 1.714112          ?        ? 
1 1 1   15   11   13 o 60.15715 0.9497969   63.69356   106.8   36.20686 1.142741          ?        ? 
1 1 1   15   11   14 o 59.29398 1.065058   64.57769   353.8   35.18441 1.263030          ?        ? 
1 1 1   15   11   15 o 26.41502 2.106130   21.01010    91.4   7.006810 1.112669          ?        ? 
1 1 1   15   11   16 o 86.95920 1.210366   86.68446    49.3   75.75173 2.105050          ?        ? 
1 1 1   15   11   17 o 24.65137 2.195816   34.69609    97.4   6.134717 1.082597          ?        ? 
1 1 1   15   11   18 o 21.09429 2.708651   10.52537     3.9   4.540894 1.142741          ?        ? 
1 1 1   15   11   19 o 9.827181 3.659977   8.905174    42.1  0.8119479 0.9623086          ?        ? 
1 1 1   15   11   20 o 20.58944 2.775067   26.59407   128.2   4.420605 1.142741          ?        ? 
1 1 1   15   11   21 o 31.98035 1.880664   28.26966    23.5   10.49518 1.202886          ?        ? 
1 1 1   15   11   22 o 14.08429 3.691680   16.08760   272.3   2.375700 1.052525          ?        ? 
1 1 1   15   12    0 f 139.2326 1.879836   197.4233     0.0   193.9954 5.232553   193.9954 5.232553 
1 1 1   15   12    1 o 132.6670 1.484714   170.1500   259.0   176.0423 3.939451          ?        ? 
1 1 1   15   12    2 o 150.1960 1.391525   175.8204    52.6   225.6313 4.180028          ?        ? 
1 1 1   15   12    3 o 120.6344 1.233953   80.52428   298.0   145.5492 2.977142          ?        ? 
1 1 1   15   12    4 o 159.7671 1.430510   180.7815   125.3   255.3125 4.570966          ?        ? 
1 1 1   15   12    5 o 205.8324 1.702066   249.6058   276.6   423.8368 7.006810          ?        ? 
1 1 1   15   12    6 o 20.14264 1.866199   9.310826    13.8   4.059740 0.7518036          ?        ? 
1 1 1   15   12    7 o 40.25578 1.083189   65.04499    64.5   16.20889 0.8720922          ?        ? 
1 1 1   15   12    8 o 53.49922 0.9836827   60.11081     9.9   28.62868 1.052525          ?        ? 
1 1 1   15   12    9 o 71.57304 0.9873765   94.75010   178.7   51.24293 1.413391          ?        ? 
1 1 1   15   12   10 o 73.57475 1.124005   113.7418   307.3   54.15993 1.653968          ?        ? 
1 1 1   15   12   11 o 53.49467 0.9556587   52.84724    37.0   28.62868 1.022453          ?        ? 
1 1 1   15   12   12 o 88.93907 1.031268   105.7780    91.9   79.14989 1.834401          ?        ? 
1 1 1   15   12   13 o 16.78864 2.239024   19.51667   203.2   2.826782 0.7518036          ?        ? 
1 1 1   15   12   14 o 80.98753 1.113955   94.17708   214.2   65.64749 1.804329          ?        ? 
1 1 1   15   12   15 o 50.93683 1.210281   51.99404    73.0   25.98233 1.232958          ?        ? 
1 1 1   15   12   16 o 44.53202 1.350585   41.22831   160.8   19.87769 1.202886          ?        ? 
1 1 1   15   12   17 o 9.759249 3.697682   22.12965    56.3  0.7217315 0.9923807          ?        ? 
1 1 1   15   12   18 o 14.17548 3.907249   21.69255    59.5   2.165194 1.142741          ?        ? 
1 1 1   15   12   19 o 16.80019 3.594913   12.46598   339.7   3.067359 1.172814          ?        ? 
1 1 1   15   12   20 o 56.80744 1.164614   62.24726   318.6   32.53806 1.323174          ?        ? 
1 1 1   15   12   21 o 11.20579 3.865105   15.76001   282.6   1.353247 1.052525          ?        ? 
1 1 1   15   12   22 o 12.82061 4.014519   6.832430    71.7   2.014834 1.142741          ?        ? 
1 1 1   15   13    0 o 88.49408 2.280155   201.9733     0.0   78.48830 4.029667   78.48830 4.029667 
1 1 1   15   13    1 o 439.5872 3.885685   497.2270     3.3   1935.323 34.16196          ?        ? 
1 1 1   15   13    2 o 263.3146 2.038580   307.8523   334.4   693.6441 10.73576          ?        ? 
1 1 1   15   13    3 f 344.4048 2.532172   351.7145     5.2   1186.978 17.44184          ?        ? 
1 1 1   15   13    4 o 59.99313 1.002520   76.97311   285.0   35.99636 1.202886          ?        ? 
1 1 1   15   13    5 o 144.6004 1.320592   204.3059    30.8   209.1518 3.819162          ?        ? 
1 1 1   15   13    6 o 80.96027 0.9843246   100.8670    35.4   65.55727 1.593824          ?        ? 
1 1 1   15   13    7 o 35.95346 1.254628   23.57001    26.4   12.93102 0.9021643          ?        ? 
1 1 1   15   13    8 o 71.28051 0.9914286   62.61743   292.8   50.82193 1.413391          ?        ? 
1 1 1   15   13    9 o 97.94052 1.090010   122.9760   157.4   95.96021 2.135122          ?        ? 
1 1 1   15   13   10 o 70.47095 0.9174720   87.49355   315.6   49.67918 1.293102          ?        ? 
1 1 1   15   13   11 o 76.97592 0.8204059   88.77273    26.1   59.27220 1.263030          ?        ? 
1 1 1   15   13   12 o 25.47691 1.121350   19.61641    54.9   6.495584 0.5713707          ?        ? 
1 1 1   15   13   13 o 62.60539 0.8886371   76.84195   159.3   39.21407 1.112669          ?        ? 
1 1 1   15   13   14 o 77.83440 0.9659016   104.2496   310.5   60.62545 1.503607          ?        ? 
1 1 1   15   13   15 o 34.50452 1.655930   43.68219    69.4   11.93864 1.142741          ?        ? 
1 1 1   15   13   16 o 11.27247 3.755610   29.97976   178.0   1.232958 0.9923807          ?        ? 
1 1 1   15   13   17 o 50.16264 1.318884   80.29449   198.9   25.26060 1.323174          ?        ? 
1 1 1   15   13   18 f 29.39763 2.045889   32.12017   299.5   8.750995 1.202886          ?        ? 
1 1 1   15   13   19 f 10.07053 3.848467   16.03472   194.1  0.8119479 1.082597          ?        ? 
1 1 1   15   13   20 o 20.35846 2.880409   22.40126   248.9   4.360461 1.172814          ?        ? 
1 1 1   15   13   21 o 15.50526 3.645357   16.07848   359.5   2.766637 1.112669          ?        ? 
1 1 1   15   13   22 o 15.92440 3.662187   13.79296   141.2   3.037287 1.142741          ?        ? 
1 1 1   15   14    0 o 207.3229 3.178262   291.8640     0.0   430.3625 13.17160   430.3625 13.17160 
1 1 1   15   14    1 o 201.7149 1.952980   225.1800   271.5   407.0565 7.878902          ?        ? 
1 1 1   15   14    2 o 39.00408 1.387800   60.69790   251.2   15.21651 1.082597          ?        ? 
1 1 1   15   14    3 o 43.27855 1.389702   49.71791   191.5   18.73495 1.202886          ?        ? 
1 1 1   15   14    4 o 165.0685 1.521202   177.7504   286.0   272.5739 5.022048          ?        ? 
1 1 1   15   14    5 o 78.92883 1.028709   132.1454   163.7   62.30948 1.623896          ?        ? 
1 1 1   15   14    6 o 50.67178 1.038571   125.7519   285.8   25.68161 1.052525          ?        ? 
1 1 1   15   14    7 o 164.8823 1.431726   186.9707   322.5   272.0026 4.721327          ?        ? 
1 1 1   15   14    8 f 141.8441 1.325052   203.8210   131.3   201.3029 3.759018          ?        ? 
1 1 1   15   14    9 o 145.4669 1.343735   181.3391    64.0   211.7380 3.909379          ?        ? 
1 1 1   15   14   10 o 91.92638 0.9159720   127.5181   233.6   84.53280 1.684040          ?        ? 
1 1 1   15   14   11 o 102.1293 0.9716910   108.2013    88.5   104.3503 1.984761          ?        ? 
1 1 1   15   14   12 o 28.38008 1.059621   30.65340   146.4   8.059335 0.6014429          ?        ? 
1 1 1   15   14   13 o 58.58678 0.8982617   68.74953   247.3   34.34239 1.052525          ?        ? 
1 1 1   15   14   14 o 25.69810 1.462761   28.85351   272.0   6.615872 0.7518036          ?        ? 
1 1 1   15   14   15 o 50.08131 0.9907694   46.20422   332.0   25.11024 0.9923807          ?        ? 
1 1 1   15   14   16 o 30.05742 1.850906   46.29466    67.3   9.081788 1.112669          ?        ? 
1 1 1   15   14   17 o 46.74567 1.415291   41.98813   185.5   21.95267 1.323174          ?        ? 
1 1 1   15   14   18 f 27.15893 2.159168   32.68810   357.0   7.487964 1.172814          ?        ? 
1 1 1   15   14   19 o 11.65611 4.026680   16.02572    13.6   1.383319 1.142741          ?        ? 
1 1 1   15   14   20 o 36.37494 1.818799   41.48332    29.1   13.50239 1.323174          ?        ? 
1 1 1   15   14   21 o 11.19786 3.962991   16.05763   298.4   1.353247 1.112669          ?        ? 
1 1 1   15   14   22 o 11.61957 4.073013   14.63423   235.9   1.623896 1.172814          ?        ? 
1 1 1   15   15    0 o 32.22842 3.084774   34.55438     0.0   10.67561 1.954689   10.67561 1.954689 
1 1 1   15   15    1 o 185.0081 1.869268   218.1376   282.2   342.4315 6.916593          ?        ? 
1 1 1   15   15    2 o 107.6705 1.340629   126.1140    97.2   115.9582 2.886926          ?        ? 
1 1 1   15   15    3 o 201.0840 1.824512   197.1822    53.6   404.5606 7.337603          ?        ? 
1 1 1   15   15    4 o 265.8563 2.324498   311.4339    69.3   707.4773 12.35965          ?        ? 
1 1 1   15   15    5 o 89.14075 1.163877   114.0243   204.3   79.48067 2.074978          ?        ? 
1 1 1   15   15    6 o 57.34986 1.074944   44.59325   199.7   32.89893 1.232958          ?        ? 
1 1 1   15   15    7 o 48.67170 1.112142   69.55238   128.0   23.69685 1.082597          ?        ? 
1 1 1   15   15    8 f 144.8266 1.360058   159.0446   211.5   209.8735 3.939451          ?        ? 
1 1 1   15   15    9 o 57.84395 0.8838029   68.05489   138.1   33.47030 1.022453          ?        ? 
1 1 1   15   15   10 o 123.0884 1.111626   140.4114   134.5   151.5937 2.736565          ?        ? 
1 1 1   15   15   11 o 57.60729 0.8613327   53.45277    28.9   33.19965 0.9923807          ?        ? 
1 1 1   15   15   12 o 140.7922 1.206797   196.7839   189.0   198.3859 3.398152          ?        ? 
1 1 1   15   15   13 o 35.69361 1.095260   45.60689   102.6   12.75059 0.7818757          ?        ? 
1 1 1   15   15   14 o 42.38559 1.028760   61.99058   159.2   17.98314 0.8720922          ?        ? 
1 1 1   15   15   15 o 44.00958 1.093295   25.54180     1.9   19.39653 0.9623086          ?        ? 
1 1 1   15   15   16 o 33.03360 1.365525   36.81074    68.9   10.94626 0.9021643          ?        ? 
1 1 1   15   15   17 o 6.143831 2.872015   14.03236   283.0 -0.8119479 0.8720922          ?        ? 
1 1 1   15   15   18 o 34.49611 1.743510   36.81987   342.3   12.02886 1.202886          ?        ? 
1 1 1   15   15   19 o 29.28304 2.156590   40.35678   281.9   8.781067 1.263030          ?        ? 
1 1 1   15   15   20 o 18.68838 3.426548   18.95906    58.2   3.849235 1.232958          ?        ? 
1 1 1   15   15   21 o 8.234663 3.693408   7.667528   154.2 -0.2405772 1.263030          ?        ? 
1 1 1   15   16    0 o 255.7905 2.845876   283.8177   180.0   654.9412 14.55492   654.9412 14.55492 
1 1 1   15   16    1 o 217.0253 2.071549   216.9074   126.0   471.3207 8.991571          ?        ? 
1 1 1   15   16    2 o 264.8372 2.441316   283.6484     1.8   702.0944 12.93102          ?        ? 
1 1 1   15   16    3 o 206.2886 1.982568   189.5668   308.0   425.8516 8.179624          ?        ? 
1 1 1   15   16    4 o 86.57299 1.233134   124.1839    39.6   74.96986 2.135122          ?        ? 
1 1 1   15   16    5 o 39.61229 1.366492   64.84377   172.5   15.69766 1.082597          ?        ? 
1 1 1   15   16    6 o 165.5550 1.580307   168.5885   257.7   274.2580 5.232553          ?        ? 
1 1 1   15   16    7 o 130.2352 1.281531   181.0501   159.1   169.6971 3.338008          ?        ? 
1 1 1   15   16    8 o 101.9815 1.164770   171.3717   253.2   104.0496 2.375700          ?        ? 
1 1 1   15   16    9 o 80.00113 0.9209465   89.26804    15.9   64.02360 1.473535          ?        ? 
1 1 1   15   16   10 o 48.26615 0.9345726   57.66383   358.0   23.30591 0.9021643          ?        ? 
1 1 1   15   16   11 o 86.51038 0.9385555   98.96366   279.2   74.87964 1.623896          ?        ? 
1 1 1   15   16   12 o 48.32449 0.9645591   67.99889   211.3   23.36606 0.9322364          ?        ? 
1 1 1   15   16   13 o 118.8385 1.176685   136.7567     7.4   141.3692 2.796710          ?        ? 
1 1 1   15   16   14 o 16.50119 2.278029   17.24405   166.7   2.736565 0.7518036          ?        ? 
1 1 1   15   16   15 o 56.58070 1.036408   61.44647    48.7   32.05691 1.172814          ?        ? 
1 1 1   15   16   16 o 10.06866 3.333576   14.38001   180.5  0.9923807 0.7818757          ?        ? 
1 1 1   15   16   17 o 50.76444 1.125533   35.24952    45.2   25.86205 1.142741          ?        ? 
1 1 1   15   16   18 o 26.02119 1.849087   24.55103   290.0   6.856449 0.9623086          ?        ? 
1 1 1   15   16   19 o 30.96906 2.039181   31.72182    32.5   9.803518 1.263030          ?        ? 
1 1 1   15   16   20 o 22.49142 2.740952   19.53964     0.7   5.322770 1.232958          ?        ? 
1 1 1   15   16   21 o 13.33591 4.282750   14.64254   133.2   2.165194 1.293102          ?        ? 
1 1 1   15   17    0 o 322.5828 3.440808   400.0315   180.0   1042.060 22.19324   1042.060 22.19324 
1 1 1   15   17    1 o 87.64439 1.166593   128.5295   181.2   76.83433 2.044906          ?        ? 
1 1 1   15   17    2 o 108.8740 1.339621   146.0812   235.1   118.5745 2.916998          ?        ? 
1 1 1   15   17    3 o 134.9325 1.526646   169.4290   206.0   182.1470 4.119884          ?        ? 
1 1 1   15   17    4 o 121.5852 1.434537   141.5934     3.4   147.8948 3.488369          ?        ? 
1 1 1   15   17    5 o 111.7558 1.331985   133.8802     1.8   124.9498 2.977142          ?        ? 
1 1 1   15   17    6 o 30.91308 1.605115   23.68264     0.3   9.562942 0.9923807          ?        ? 
1 1 1   15   17    7 o 172.9962 1.677471   174.6459   359.4   299.5486 5.803924          ?        ? 
1 1 1   15   17    8 o 105.0297 1.059386   128.6577   337.7   110.3648 2.225339          ?        ? 
1 1 1   15   17    9 o 11.99993 2.908179   7.391599   219.6   1.503607 0.6916593          ?        ? 
1 1 1   15   17   10 o 60.75683 0.8909264   43.26635   256.2   36.92860 1.082597          ?        ? 
1 1 1   15   17   11 o 44.94132 1.003714   54.10462   346.1   20.20848 0.9021643          ?        ? 
1 1 1   15   17   12 o 87.33630 0.9641123   109.9500     1.0   76.32310 1.684040          ?        ? 
1 1 1   15   17   13 o 67.04507 1.009207   53.72962   282.3   44.98793 1.353247          ?        ? 
1 1 1   15   17   14 o 102.9199 1.110321   107.0562    81.6   106.0645 2.285483          ?        ? 
1 1 1   15   17   15 o 18.12367 2.157056   9.916254   129.1   3.307936 0.7818757          ?        ? 
1 1 1   15   17   16 f 28.14922 1.602468   45.54835   137.4   7.969118 0.9021643          ?        ? 
1 1 1   15   17   17 o 25.25016 1.786453   24.70826   286.9   6.435439 0.9021643          ?        ? 
1 1 1   15   17   18 o 17.69390 2.634345   28.92781   175.2   3.217719 0.9322364          ?        ? 
1 1 1   15   17   19 o 36.00303 1.378191   37.14635   333.2   13.11145 0.9923807          ?        ? 
1 1 1   15   17   20 o 9.225576 3.867735   6.784214     5.9  0.3909379 1.202886          ?        ? 
1 1 1   15   17   21 o 8.872495 3.823928   11.92650    52.1  0.3007214 1.232958          ?        ? 
1 1 1   15   18    0 o 220.4070 2.661433   238.0454   180.0   486.3267 11.72814   486.3267 11.72814 
1 1 1   15   18    1 o 116.4676 1.226459   169.2732   193.2   135.6855 2.856854          ?        ? 
1 1 1   15   18    2 o 210.5261 1.814104   244.7162   104.7   443.5040 7.638325          ?        ? 
1 1 1   15   18    3 o 137.9429 1.547830   128.6473   207.1   190.3867 4.270245          ?        ? 
1 1 1   15   18    4 o 28.42955 1.851111   35.61182   174.6   8.089407 1.052525          ?        ? 
1 1 1   15   18    5 o 62.92015 1.218751   74.14596   289.2   39.60501 1.533679          ?        ? 
1 1 1   15   18    6 o 27.23749 1.932126   60.70890     2.7   7.427820 1.052525          ?        ? 
1 1 1   15   18    7 o 95.17532 1.279662   139.1689   286.5   90.63744 2.435844          ?        ? 
1 1 1   15   18    8 o 44.74108 1.142633   59.58931    13.8   20.02805 1.022453          ?        ? 
1 1 1   15   18    9 o 61.51704 0.9776850   56.73098    63.6   37.86083 1.202886          ?        ? 
1 1 1   15   18   10 o 50.90020 0.9452897   60.23276   239.1   25.92219 0.9623086          ?        ? 
1 1 1   15   18   11 o 93.40728 0.9980342   114.2100    17.2   87.29943 1.864473          ?        ? 
1 1 1   15   18   12 o 108.7981 1.022692   119.6889    70.8   118.4542 2.225339          ?        ? 
1 1 1   15   18   13 o 75.01516 1.002202   67.79055    40.9   56.32513 1.503607          ?        ? 
1 1 1   15   18   14 o 51.89861 1.100936   64.41802   187.5   26.97471 1.142741          ?        ? 
1 1 1   15   18   15 o 13.61189 3.152434   22.01420   266.7   1.954689 0.8420200          ?        ? 
1 1 1   15   18   16 o 46.07625 1.109523   54.99584   242.1   21.29108 1.022453          ?        ? 
1 1 1   15   18   17 o 13.75454 2.929411   21.40167   345.4   2.014834 0.7818757          ?        ? 
1 1 1   15   18   18 o 8.689575 3.422024   18.13251   113.2  0.5112265 0.8720922          ?        ? 
1 1 1   15   18   19 o 27.86801 1.888411   26.73684    96.5   7.939046 1.052525          ?        ? 
1 1 1   15   18   20 o 15.45013 3.400759   11.49847   216.5   2.706493 1.022453          ?        ? 
1 1 1   15   18   21 f 17.38659 3.495698   20.63094    72.6   3.548513 1.172814          ?        ? 
1 1 1   15   19    0 o 42.67271 1.803990   60.80983     0.0   18.31394 1.533679   18.31394 1.533679 
1 1 1   15   19    1 o 65.58813 1.215024   93.28656   278.7   43.03324 1.593824          ?        ? 
1 1 1   15   19    2 o 137.1496 1.392335   156.6733   130.1   188.1915 3.819162          ?        ? 
1 1 1   15   19    3 o 233.9729 2.184981   269.3712   106.7   548.0949 10.22453          ?        ? 
1 1 1   15   19    4 o 127.1792 1.536957   136.9307   204.1   161.8483 3.909379          ?        ? 
1 1 1   15   19    5 o 133.9085 1.470949   178.5390   118.9   179.4405 3.939451          ?        ? 
1 1 1   15   19    6 o 81.85159 1.230785   92.87110    17.5   67.03081 2.014834          ?        ? 
1 1 1   15   19    7 o 105.3835 1.383992   110.8686   132.4   111.1467 2.916998          ?        ? 
1 1 1   15   19    8 o 40.76670 1.180263   40.81077   230.9   16.62990 0.9623086          ?        ? 
1 1 1   15   19    9 o 117.5957 1.227480   128.1745    78.5   138.3920 2.886926          ?        ? 
1 1 1   15   19   10 o 117.7401 1.111039   158.3886   142.9   138.7228 2.616277          ?        ? 
1 1 1   15   19   11 o 90.39420 1.014667   101.2676    74.8   81.76616 1.834401          ?        ? 
1 1 1   15   19   12 o 57.83208 0.9879824   58.68472   325.3   33.47030 1.142741          ?        ? 
1 1 1   15   19   13 o 35.30085 1.235228   35.74944   143.3   12.47994 0.8720922          ?        ? 
1 1 1   15   19   14 o 67.98692 1.017342   63.79116   309.2   46.28103 1.383319          ?        ? 
1 1 1   15   19   15 o 10.09850 3.459415   18.03172   210.4  0.9623086 0.8420200          ?        ? 
1 1 1   15   19   16 o 52.45890 1.089178   58.04847   343.5   27.60623 1.142741          ?        ? 
1 1 1   15   19   17 o 27.73111 1.572408   41.71986    16.4   7.758613 0.8720922          ?        ? 
1 1 1   15   19   18 o 10.95873 3.698275   13.32780   146.7   1.232958 0.9623086          ?        ? 
1 1 1   15   19   19 o 25.63454 1.994287   28.41212   118.0   6.736160 1.022453          ?        ? 
1 1 1   15   19   20 o 14.05468 3.616983   9.389771   213.8   2.285483 1.022453          ?        ? 
1 1 1   15   19   21 f 14.54618 3.626407   13.20623    99.5   2.556132 1.052525          ?        ? 
1 1 1   15   20    0 o 61.55071 1.663845   100.6859    -0.0   37.98112 2.044906   37.98112 2.044906 
1 1 1   15   20    1 o 85.34625 1.162770   134.0940   285.9   72.86481 1.984761          ?        ? 
1 1 1   15   20    2 o 182.9281 1.611054   176.5390   272.5   334.8533 5.894140          ?        ? 
1 1 1   15   20    3 o 86.37922 1.079237   72.38383   151.8   74.63906 1.864473          ?        ? 
1 1 1   15   20    4 o 133.9166 1.515772   172.7701   138.6   179.4706 4.059740          ?        ? 
1 1 1   15   20    5 o 66.51706 1.198056   71.53934    69.8   44.26620 1.593824          ?        ? 
1 1 1   15   20    6 o 64.76992 1.276803   56.13906   137.2   41.98072 1.653968          ?        ? 
1 1 1   15   20    7 o 131.3093 1.362655   138.4216   180.1   172.5540 3.578585          ?        ? 
1 1 1   15   20    8 o 101.1158 1.130132   120.6303    18.8   102.3054 2.285483          ?        ? 
1 1 1   15   20    9 o 125.4990 1.210085   148.8532   307.9   157.6382 3.037287          ?        ? 
1 1 1   15   20   10 o 50.06145 1.141339   68.87595   289.7   25.08017 1.142741          ?        ? 
1 1 1   15   20   11 o 49.54741 1.092486   48.73250   333.8   24.56894 1.082597          ?        ? 
1 1 1   15   20   12 o 85.47918 1.037830   90.64417   109.6   73.13545 1.774257          ?        ? 
1 1 1   15   20   13 o 86.96546 1.037382   110.3960   344.0   75.72166 1.804329          ?        ? 
1 1 1   15   20   14 o 39.52881 1.331339   32.07201   108.0   15.66759 1.052525          ?        ? 
1 1 1   15   20   15 o 66.66797 1.105130   50.03269   277.7   44.56692 1.473535          ?        ? 
1 1 1   15   20   16 o 16.37597 2.662719   23.72636   216.7   2.736565 0.8720922          ?        ? 
1 1 1   15   20   17 o 7.879752 3.265422   13.74553   242.4  0.2105050 0.8420200          ?        ? 
1 1 1   15   20   18 o 9.626539 3.682931   15.52625    95.8  0.7518036 0.9923807          ?        ? 
1 1 1   15   20   19 o 42.04015 1.430640   37.89938   213.9   17.92300 1.202886          ?        ? 
1 1 1   15   20   20 o 25.20825 2.147308   24.50644     9.4   6.645944 1.082597          ?        ? 
1 1 1   15   21    0 o 9.728418 5.142040   38.17136     0.0   1.383319 1.323174   1.383319 1.323174 
1 1 1   15   21    1 o 64.15073 1.101617   80.08791   100.9   41.16877 1.413391          ?        ? 
1 1 1   15   21    2 o 58.04651 1.243368   96.04162   318.9   33.71087 1.443463          ?        ? 
1 1 1   15   21    3 o 103.9365 1.215194   127.6938   106.0   108.0793 2.526060          ?        ? 
1 1 1   15   21    4 o 68.80652 1.114487   91.88644   292.1   47.36363 1.533679          ?        ? 
1 1 1   15   21    5 o 83.38953 1.280210   86.45714    70.0   69.58694 2.135122          ?        ? 
1 1 1   15   21    6 o 106.4536 1.313582   105.4410   136.5   113.4021 2.796710          ?        ? 
1 1 1   15   21    7 o 159.6464 1.459846   150.1611   341.2   255.1321 4.661182          ?        ? 
1 1 1   15   21    8 o 119.2246 1.261155   145.8666   311.2   142.2713 3.007215          ?        ? 
1 1 1   15   21    9 o 40.76408 1.180339   44.14240   123.9   16.62990 0.9623086          ?        ? 
1 1 1   15   21   10 o 114.8141 1.244121   164.4491   328.2   131.9566 2.856854          ?        ? 
1 1 1   15   21   11 o 55.60457 1.054602   54.06734     8.2   30.94424 1.172814          ?        ? 
1 1 1   15   21   12 o 103.8444 1.085957   110.8756   205.8   107.9590 2.255411          ?        ? 
1 1 1   15   21   13 o 80.01382 1.089927   81.19436   133.1   64.11382 1.744184          ?        ? 
1 1 1   15   21   14 o 16.99128 2.566293   26.45870   125.1   2.916998 0.8720922          ?        ? 
1 1 1   15   21   15 o 9.949616 3.509783   24.57184    48.9  0.9021643 0.8720922          ?        ? 
1 1 1   15   21   16 o 58.19130 1.059401   63.66878   240.9   33.98153 1.232958          ?        ? 
1 1 1   15   21   17 o 10.73004 3.580834   7.633614   149.0   1.172814 0.9021643          ?        ? 
1 1 1   15   21   18 o 17.23413 2.617377   14.03252    73.7   3.097431 0.9021643          ?        ? 
1 1 1   15   21   19 o 6.326540 2.982150   2.199068   103.5 -0.9623086 0.9923807          ?        ? 
1 1 1   15   21   20 o 18.18066 2.811925   20.89858   250.6   3.608657 1.022453          ?        ? 
1 1 1   15   22    0 o 63.98482 1.718201   44.88498     0.0   41.04848 2.195267   41.04848 2.195267 
1 1 1   15   22    1 o 192.3028 1.720170   170.9116   356.7   370.1581 6.615872          ?        ? 
1 1 1   15   22    2 o 18.16331 2.814610   26.95769   287.4   3.307936 1.022453          ?        ? 
1 1 1   15   22    3 o 110.3828 1.198714   127.0338    12.0   121.9125 2.646349          ?        ? 
1 1 1   15   22    4 o 118.0086 1.261409   123.5506     1.5   139.3543 2.977142          ?        ? 
1 1 1   15   22    5 o 57.73350 1.171977   101.2099    65.6   33.35001 1.353247          ?        ? 
1 1 1   15   22    6 f 63.05035 1.287777   86.55805   179.8   39.78545 1.623896          ?        ? 
1 1 1   15   22    7 o 51.19031 1.174916   65.03867    87.8   26.22291 1.202886          ?        ? 
1 1 1   15   22    8 o 97.93732 1.151456   133.9597    73.1   95.99029 2.255411          ?        ? 
1 1 1   15   22    9 o 76.88269 1.095201   94.16924   127.7   59.15191 1.684040          ?        ? 
1 1 1   15   22   10 o 110.1266 1.228810   116.1891   240.0   121.4013 2.706493          ?        ? 
1 1 1   15   22   11 o 33.50089 1.570891   66.88850   214.4   11.24698 1.052525          ?        ? 
1 1 1   15   22   12 o 59.60786 1.084674   74.15954   295.7   35.57535 1.293102          ?        ? 
1 1 1   15   22   13 o 85.87255 1.190663   81.99426   304.5   73.88726 2.044906          ?        ? 
1 1 1   15   22   14 o 18.30007 2.629248   23.64048   290.9   3.398152 0.9623086          ?        ? 
1 1 1   15   22   15 o 73.65551 1.102359   76.21226   180.5   54.43058 1.623896          ?        ? 
1 1 1   15   22   16 o 33.31433 1.489420   38.98018    40.3   11.18684 0.9923807          ?        ? 
1 1 1   15   22   17 o 30.37456 1.633572   35.88101    38.3   9.352437 0.9923807          ?        ? 
1 1 1   15   22   18 o 7.376352 3.251066   9.186247   252.2 -0.1503607 0.9322364          ?        ? 
1 1 1   15   22   19 o 14.43013 3.643995   14.84983   298.7   2.405771 1.052525          ?        ? 
1 1 1   15   22   20 o 25.82322 2.212624   25.79519   188.9   7.066954 1.142741          ?        ? 
1 1 1   15   23    0 o 6.067483 4.105110   43.63309     0.0 -0.5713707 1.413391 -0.5713707 1.413391 
1 1 1   15   23    1 o 29.66365 1.774099   18.06487   135.5   8.811138 1.052525          ?        ? 
1 1 1   15   23    2 o 167.8310 1.621589   179.1371    77.6   281.9865 5.443058          ?        ? 
1 1 1   15   23    3 o 129.7237 1.344538   128.9096   299.8   168.4040 3.488369          ?        ? 
1 1 1   15   23    4 o 49.58110 1.243375   70.66877     5.2   24.59902 1.232958          ?        ? 
1 1 1   15   23    5 o 98.54011 1.144413   129.9319   230.7   97.16310 2.255411          ?        ? 
1 1 1   15   23    6 o 53.40621 1.069858   71.31036   122.8   28.53847 1.142741          ?        ? 
1 1 1   15   23    7 o 71.17663 1.161876   76.78898   184.7   50.70164 1.653968          ?        ? 
1 1 1   15   23    8 o 34.26881 1.491812   61.95731   135.5   11.75821 1.022453          ?        ? 
1 1 1   15   23    9 o 96.44886 1.138047   121.5654   142.7   93.10336 2.195267          ?        ? 
1 1 1   15   23   10 o 13.45515 3.531376   28.01401    98.1   1.894545 0.9623086          ?        ? 
1 1 1   15   23   11 o 84.08531 1.126561   72.82054    48.0   70.78983 1.894545          ?        ? 
1 1 1   15   23   12 o 97.41408 1.188512   107.3134   276.1   95.05805 2.315555          ?        ? 
1 1 1   15   23   13 o 43.44034 1.246074   63.27579    56.0   18.91538 1.082597          ?        ? 
1 1 1   15   23   14 f 58.08373 1.113136   67.11755   100.1   33.83116 1.293102          ?        ? 
1 1 1   15   23   15 o 10.32092 3.630005   12.07540   102.8  0.9923807 0.9322364          ?        ? 
1 1 1   15   23   16 o 39.72368 1.286957   51.51146     8.8   15.87809 1.022453          ?        ? 
1 1 1   15   23   17 o 14.21037 3.421813   13.79497   163.4   2.225339 0.9623086          ?        ? 
1 1 1   15   23   18 o 33.36131 1.667605   31.85091   231.2   11.33720 1.112669          ?        ? 
1 1 1   15   23   19 o 29.70309 1.771743   25.95235   247.3   9.081788 1.052525          ?        ? 
1 1 1   15   23   20 o 20.75080 2.608568   20.47425   134.5   4.691255 1.082597          ?        ? 
1 1 1   15   24    0 o 34.30877 2.480214   58.35862     0.0   11.96871 1.684040   11.96871 1.684040 
1 1 1   15   24    1 o 89.91324 1.237492   97.24848    69.9   80.89407 2.225339          ?        ? 
1 1 1   15   24    2 o 54.37702 1.327273   56.95503   331.1   29.59099 1.443463          ?        ? 
1 1 1   15   24    3 o 116.2051 1.293926   127.3059   190.9   135.1442 3.007215          ?        ? 
1 1 1   15   24    4 o 47.88309 1.256065   46.68701   173.7   22.94505 1.202886          ?        ? 
1 1 1   15   24    5 o 83.73210 1.149271   82.62191    47.8   70.15832 1.924617          ?        ? 
1 1 1   15   24    6 o 51.39251 1.170293   63.48396   153.0   26.43342 1.202886          ?        ? 
1 1 1   15   24    7 o 26.67690 1.634546   31.01336   198.1   7.127099 0.8720922          ?        ? 
1 1 1   15   24    8 o 80.72881 1.136150   82.13477    93.5   65.22648 1.834401          ?        ? 
1 1 1   15   24    9 f 65.91119 1.163444   71.53418   136.5   43.48432 1.533679          ?        ? 
1 1 1   15   24   10 o 96.33039 1.233100   100.6378    28.2   92.92293 2.375700          ?        ? 
1 1 1   15   24   11 o 18.76582 2.644118   5.785823   142.1   3.548513 0.9923807          ?        ? 
1 1 1   15   24   12 o 61.62177 1.146827   65.68127    81.9   38.04126 1.413391          ?        ? 
1 1 1   15   24   13 o 37.04523 1.339418   32.59574   110.2   13.77304 0.9923807          ?        ? 
1 1 1   15   24   14 o 18.88971 2.785974   17.81227     6.5   3.638730 1.052525          ?        ? 
1 1 1   15   24   15 o 6.941435 3.157451   16.93654   219.1 -0.5412986 0.9623086          ?        ? 
1 1 1   15   24   16 o 15.34829 3.235984   15.75723   196.8   2.556132 0.9623086          ?        ? 
1 1 1   15   24   17 o 9.594200 3.596539   8.100778   168.9  0.8119479 0.9322364          ?        ? 
1 1 1   15   24   18 o 6.113897 2.884397   1.856537   302.5 -0.9322364 0.9322364          ?        ? 
1 1 1   15   24   19 o 12.22343 3.723898   21.36372    38.5   1.774257 0.9923807          ?        ? 
1 1 1   15   25    0 o 10.38589 5.403756   18.61219   180.0   1.593824 1.443463   1.593824 1.443463 
1 1 1   15   25    1 o 40.23867 1.494689   43.65042    68.1   16.20889 1.202886          ?        ? 
1 1 1   15   25    2 o 50.15046 1.289223   34.74900   169.3   25.17038 1.293102          ?        ? 
1 1 1   15   25    3 o 15.34696 3.669342   61.31797   351.3   2.465916 1.112669          ?        ? 
1 1 1   15   25    4 o 96.43179 1.247396   87.36491    56.7   93.07329 2.405771          ?        ? 
1 1 1   15   25    5 o 70.45406 1.195133   73.56887   335.7   49.67918 1.684040          ?        ? 
1 1 1   15   25    6 o 57.44313 1.099374   37.15054   176.3   33.01921 1.263030          ?        ? 
1 1 1   15   25    7 o 64.30276 1.075629   83.43877   163.1   41.37927 1.383319          ?        ? 
1 1 1   15   25    8 o 111.7841 1.156785   104.2748    60.3   125.0700 2.586205          ?        ? 
1 1 1   15   25    9 o 65.24056 1.175403   46.98932   329.9   42.61223 1.533679          ?        ? 
1 1 1   15   25   10 o 36.12423 1.581683   32.81060   219.6   13.08138 1.142741          ?        ? 
1 1 1   15   25   11 o 49.08702 1.347785   49.02021   146.4   24.14793 1.323174          ?        ? 
1 1 1   15   25   12 o 71.80221 1.172694   61.28580   104.4   51.66394 1.684040          ?        ? 
1 1 1   15   25   13 o 22.87082 2.301022   25.76496   122.6   5.292697 1.052525          ?        ? 
1 1 1   15   25   14 f 39.48855 1.523082   54.20833    19.7   15.69766 1.202886          ?        ? 
1 1 1   15   25   15 o 41.59550 1.482081   51.58982    47.4   17.44184 1.232958          ?        ? 
1 1 1   15   25   16 o 10.36161 3.785632   4.221486   264.2  0.9923807 1.022453          ?        ? 
1 1 1   15   25   17 o 29.49299 1.784365   29.21282   284.8   8.871283 1.052525          ?        ? 
1 1 1   15   25   18 o 24.21628 2.297358   17.66288   179.6   6.134717 1.112669          ?        ? 
1 1 1   15   25   19 o 11.03992 3.809335   13.58168    71.9   1.413391 1.022453          ?        ? 
1 1 1   15   26    0 o 52.81905 1.855371   40.14072   180.0   28.02724 1.954689   28.02724 1.954689 
1 1 1   15   26    1 o 104.1616 1.255873   124.8034   141.6   108.5905 2.616277          ?        ? 
1 1 1   15   26    2 o 149.2221 1.471141   162.7889   231.4   222.9549 4.390533          ?        ? 
1 1 1   15   26    3 o 91.69074 1.180705   75.71667   281.1   84.14186 2.165194          ?        ? 
1 1 1   15   26    4 o 78.82928 1.182602   89.21541   135.8   62.18920 1.864473          ?        ? 
1 1 1   15   26    5 o 88.17381 1.074324   93.24090   119.1   77.79664 1.894545          ?        ? 
1 1 1   15   26    6 o 126.9372 1.184529   111.2528    48.4   161.2769 3.007215          ?        ? 
1 1 1   15   26    7 o 43.74385 1.271801   39.41268   176.6   19.15596 1.112669          ?        ? 
1 1 1   15   26    8 o 43.32177 1.353608   60.85061   250.6   18.79509 1.172814          ?        ? 
1 1 1   15   26    9 o 70.40065 1.089251   71.02414    62.4   49.61904 1.533679          ?        ? 
1 1 1   15   26   10 o 28.85556 1.823782   21.32045    70.6   8.360056 1.052525          ?        ? 
1 1 1   15   26   11 o 40.45738 1.449443   47.61889   102.9   16.41939 1.172814          ?        ? 
1 1 1   15   26   12 o 71.44238 1.157554   90.39973   223.1   51.18279 1.653968          ?        ? 
1 1 1   15   26   13 o 19.14864 2.591257   40.80290   213.9   3.728946 0.9923807          ?        ? 
1 1 1   15   26   14 o 66.69968 1.262405   74.15729   158.7   44.71728 1.684040          ?        ? 
1 1 1   15   26   15 o 14.72541 3.599247   11.63640    73.6   2.375700 1.052525          ?        ? 
1 1 1   15   26   16 o 46.90116 1.410599   51.19445   142.0   22.25339 1.323174          ?        ? 
1 1 1   15   26   17 o 12.47182 3.560400   13.13905   118.9   1.744184 0.9322364          ?        ? 
1 1 1   15   26   18 o 11.17020 3.863919   9.914758    66.5   1.383319 1.052525          ?        ? 
1 1 1   15   26   19 o 11.85553 3.867747   16.78528   205.9   1.714112 1.052525          ?        ? 
1 1 1   15   27    0 o 30.30910 2.979613   60.67495    -0.0   9.472726 1.774257   9.472726 1.774257 
1 1 1   15   27    1 o 43.73802 1.546991   43.52424   200.4   19.15596 1.353247          ?        ? 
1 1 1   15   27    2 o 24.60598 2.444296   18.61513   100.6   6.074574 1.202886          ?        ? 
1 1 1   15   27    3 o 135.9440 1.382561   141.7507   308.7   185.0038 3.759018          ?        ? 
1 1 1   15   27    4 o 107.5049 1.286749   111.2797   327.8   115.6875 2.766637          ?        ? 
1 1 1   15   27    5 o 60.19816 1.099016   32.18254   213.3   36.26701 1.323174          ?        ? 
1 1 1   15   27    6 o 55.33111 1.168513   34.33910   158.8   30.64352 1.293102          ?        ? 
1 1 1   15   27    7 o 47.36759 1.237992   56.26687   350.7   22.46389 1.172814          ?        ? 
1 1 1   15   27    8 o 91.26227 1.136822   110.5092   279.6   83.39005 2.074978          ?        ? 
1 1 1   15   27    9 o 38.34190 1.450984   41.11909   343.1   14.73535 1.112669          ?        ? 
1 1 1   15   27   10 o 24.63644 2.136114   34.79307    87.3   6.104645 1.052525          ?        ? 
1 1 1   15   27   11 o 26.61715 1.920666   32.74409   105.1   7.127099 1.022453          ?        ? 
1 1 1   15   27   12 o 31.97609 1.974960   47.48384   151.2   10.31474 1.263030          ?        ? 
1 1 1   15   27   13 o 22.36563 2.352996   20.28771    68.0   5.082192 1.052525          ?        ? 
1 1 1   15   27   14 o 9.897980 3.976625   10.88683   270.4  0.5713707 1.202886          ?        ? 
1 1 1   15   27   15 o 19.07438 2.837831   18.50392   263.1   3.789090 1.082597          ?        ? 
1 1 1   15   27   16 o 8.310721 3.499935   8.111044   174.3  0.2105050 0.9923807          ?        ? 
1 1 1   15   27   17 o 13.34638 3.624601   11.25924   168.5   2.044906 0.9923807          ?        ? 
1 1 1   15   27   18 o 8.444591 3.635978   8.206643   323.2  0.2405772 1.112669          ?        ? 
1 1 1   15   28    0 o 104.8481 1.894369   105.0968    -0.0   110.1543 3.969523   110.1543 3.969523 
1 1 1   15   28    1 o 154.1968 1.491938   149.3382   292.7   238.0812 4.601038          ?        ? 
1 1 1   15   28    2 o 93.79750 1.362580   107.5361   341.2   88.08131 2.556132          ?        ? 
1 1 1   15   28    3 o 112.2205 1.246078   103.2079   259.9   126.0624 2.796710          ?        ? 
1 1 1   15   28    4 o 84.38127 1.211706   79.66404   134.1   71.27098 2.044906          ?        ? 
1 1 1   15   28    5 o 52.97486 1.106953   63.59753   162.9   28.08738 1.172814          ?        ? 
1 1 1   15   28    6 o 65.68246 1.098819   74.29352   191.4   43.18360 1.443463          ?        ? 
1 1 1   15   28    7 o 34.28910 1.666333   42.97287   303.8   11.78828 1.142741          ?        ? 
1 1 1   15   28    8 o 49.89162 1.205499   31.92834   330.4   24.92981 1.202886          ?        ? 
1 1 1   15   28    9 o 94.05701 1.087057   103.3025   299.9   88.59254 2.044906          ?        ? 
1 1 1   15   28   10 o 66.31447 1.088347   62.17490    14.2   44.05569 1.443463          ?        ? 
1 1 1   15   28   11 f 8.899526 3.564554   15.34443   144.4  0.4210100 0.9623086          ?        ? 
1 1 1   15   28   12 o 32.92760 1.598241   39.43546   350.2   10.91619 1.052525          ?        ? 
1 1 1   15   28   13 o 8.964840 3.639620   17.53049   258.8  0.3909379 1.022453          ?        ? 
1 1 1   15   28   14 o 29.52309 2.037195   37.09602   171.0   8.871283 1.202886          ?        ? 
1 1 1   15   28   15 o 54.10793 1.445030   47.80405   107.0   29.62106 1.563751          ?        ? 
1 1 1   15   28   16 o 9.837744 3.784775   1.111989    85.5  0.8119479 1.052525          ?        ? 
1 1 1   15   28   17 o 14.40202 3.648256   8.820104    87.6   2.405771 1.052525          ?        ? 
1 1 1   15   28   18 o 16.87831 3.415503   19.77234   215.1   3.338008 1.112669          ?        ? 
1 1 1   15   29    0 o 8.749149 5.717854   3.515803     0.0      -0.09 2.375700      -0.09 2.375700 
1 1 1   15   29    1 o 122.8775 1.358266   94.09520   311.0   151.1727 3.338008          ?        ? 
1 1 1   15   29    2 o 89.18757 1.281279   73.93001   292.5   79.63103 2.285483          ?        ? 
1 1 1   15   29    3 o 103.4162 1.206769   109.4414    35.8   107.0568 2.495988          ?        ? 
1 1 1   15   29    4 o 37.15257 1.699788   25.52074   200.2   13.83319 1.263030          ?        ? 
1 1 1   15   29    5 o 62.27570 1.110641   51.86436    59.6   38.82314 1.383319          ?        ? 
1 1 1   15   29    6 o 100.2895 1.169428   93.79077   212.1   100.7116 2.345627          ?        ? 
1 1 1   15   29    7 o 142.1071 1.227373   106.8176   291.7   202.2652 3.488369          ?        ? 
1 1 1   15   29    8 o 22.27243 2.295333   25.31824   214.7   4.991976 1.022453          ?        ? 
1 1 1   15   29    9 o 77.51601 1.125048   68.46709   312.6   60.20443 1.744184          ?        ? 
1 1 1   15   29   10 o 8.321008 3.558066   18.14753   118.0   0.000000 1.052525          ?        ? 
1 1 1   15   29   11 o 70.10571 1.093834   58.13170   283.4   49.28824 1.533679          ?        ? 
1 1 1   15   29   12 o 58.64049 1.153850   57.45382   198.8   34.52282 1.353247          ?        ? 
1 1 1   15   29   13 o 16.99287 3.028799   20.67941   340.9   3.067359 0.9923807          ?        ? 
1 1 1   15   29   14 o 15.48839 3.566273   17.57612   111.7   2.646349 1.082597          ?        ? 
1 1 1   15   29   15 o 27.24802 2.152108   20.26381   327.7   7.638325 1.172814          ?        ? 
1 1 1   15   29   16 o 29.82771 2.066800   26.01044   287.4   9.202076 1.232958          ?        ? 
1 1 1   15   29   17 o 9.277383 3.820475   2.681163    62.5  0.6014429 1.142741          ?        ? 
1 1 1   15   30    0 o 42.36479 2.430156   25.22109   180.0   18.16358 2.044906   18.16358 2.044906 
1 1 1   15   30    1 o 31.35104 2.158216   17.77073   202.6   9.863664 1.353247          ?        ? 
1 1 1   15   30    2 o 60.37182 1.444535   62.46800   155.7   36.50758 1.744184          ?        ? 
1 1 1   15   30    3 o 88.31365 1.259906   89.22552   310.6   78.09737 2.225339          ?        ? 
1 1 1   15   30    4 o 14.26146 4.168086   5.542321   287.2   2.105050 1.263030          ?        ? 
1 1 1   15   30    5 o 58.58855 1.180537   49.41011    66.3   34.37246 1.383319          ?        ? 
1 1 1   15   30    6 o 25.93794 2.260807   22.67989    12.6   6.766232 1.172814          ?        ? 
1 1 1   15   30    7 o 14.71789 3.516493   5.522858    73.6   2.285483 1.022453          ?        ? 
1 1 1   15   30    8 o 85.06313 1.148964   62.35511   255.7   72.50394 1.954689          ?        ? 
1 1 1   15   30    9 o 27.69453 2.008825   41.69598    43.0   7.728541 1.112669          ?        ? 
1 1 1   15   30   10 o 78.37508 1.170271   81.87822   196.9   61.61782 1.834401          ?        ? 
1 1 1   15   30   11 o 26.31185 2.057243   13.52158   140.7   7.006810 1.082597          ?        ? 
1 1 1   15   30   12 o 11.39777 3.755614   15.87433   209.7   1.323174 0.9923807          ?        ? 
1 1 1   15   30   13 o 18.34950 2.786051   16.84814   208.6   3.488369 1.022453          ?        ? 
1 1 1   15   30   14 o 36.23899 1.576674   44.97729   288.4   13.32196 1.142741          ?        ? 
1 1 1   15   30   15 o 37.42406 1.727635   32.14480   167.5   14.28427 1.293102          ?        ? 
1 1 1   15   30   16 o 12.30953 3.974695   10.42994   145.9   1.744184 1.112669          ?        ? 
1 1 1   15   30   17 o 9.530272 3.793797   12.00698   253.3  0.8119479 1.082597          ?        ? 
1 1 1   15   31    0 o 45.15507 2.310439   38.94839     0.0   20.59942 2.074978   20.59942 2.074978 
1 1 1   15   31    1 o 39.78607 1.814031   30.68992    77.9   15.87809 1.443463          ?        ? 
1 1 1   15   31    2 o 95.16901 1.342944   94.11929    55.4   90.72766 2.556132          ?        ? 
1 1 1   15   31    3 o 86.19415 1.203665   90.17651    83.7   74.39848 2.074978          ?        ? 
1 1 1   15   31    4 o 62.79412 1.149362   75.87971    66.4   39.48473 1.443463          ?        ? 
1 1 1   15   31    5 o 63.36048 1.115357   50.49010   214.2   40.20646 1.413391          ?        ? 
1 1 1   15   31    6 o 48.81236 1.324564   27.12547   235.2   23.87728 1.293102          ?        ? 
1 1 1   15   31    7 o 84.01073 1.181255   105.4369   118.4   70.72968 1.984761          ?        ? 
1 1 1   15   31    8 o 18.28666 2.960073   29.09243   167.1   3.398152 1.082597          ?        ? 
1 1 1   15   31    9 o 66.53168 1.107394   81.96283    42.0   44.38649 1.473535          ?        ? 
1 1 1   15   31   10 o 53.97554 1.253574   60.39380    16.0   29.26020 1.353247          ?        ? 
1 1 1   15   31   11 o 26.07002 2.018650   26.42121   321.1   6.886521 1.052525          ?        ? 
1 1 1   15   31   12 o 30.17494 1.893528   26.22374    30.9   9.232149 1.142741          ?        ? 
1 1 1   15   31   13 o 29.13219 1.806464   25.47425   300.1   8.630706 1.052525          ?        ? 
1 1 1   15   31   14 o 11.63083 4.025836   9.502934   216.3   1.413391 1.142741          ?        ? 
1 1 1   15   31   15 o 9.469066 3.846609   6.531725   227.3  0.6014429 1.142741          ?        ? 
1 1 1   15   31   16 o 23.56684 2.488271   27.81362   206.0   5.924213 1.172814          ?        ? 
1 1 1   15   32    0 o 15.55597 6.213562   9.570248   360.0   3.398152 1.864473   3.398152 1.864473 
1 1 1   15   32    1 o 22.56384 3.065345   27.77510    45.5   5.142337 1.383319          ?        ? 
1 1 1   15   32    2 o 27.26855 2.481332   18.49043   172.0   7.487964 1.353247          ?        ? 
1 1 1   15   32    3 o 45.74261 1.610681   60.53130   125.1   20.99036 1.473535          ?        ? 
1 1 1   15   32    4 o 36.93166 1.628530   48.19012   269.9   13.68283 1.202886          ?        ? 
1 1 1   15   32    5 o 38.48482 1.484665   34.62102   123.7   14.85564 1.142741          ?        ? 
1 1 1   15   32    6 o 63.20828 1.094254   72.31046   304.3   40.02603 1.383319          ?        ? 
1 1 1   15   32    7 o 34.59560 1.608108   25.77434   336.6   12.02886 1.112669          ?        ? 
1 1 1   15   32    8 o 42.48326 1.451110   48.17788   276.2   18.13350 1.232958          ?        ? 
1 1 1   15   32    9 o 12.00364 3.864769   11.07244   137.8   1.473535 1.052525          ?        ? 
1 1 1   15   32   10 o 27.09647 1.942182   25.99157    15.0   7.427820 1.052525          ?        ? 
1 1 1   15   32   11 o 13.42696 3.767242   13.48799    54.1   1.954689 1.052525          ?        ? 
1 1 1   15   32   12 o 39.74077 1.475580   42.21984    14.0   15.96831 1.172814          ?        ? 
1 1 1   15   32   13 o 45.52249 1.354230   39.64816     8.4   20.96028 1.232958          ?        ? 
1 1 1   15   32   14 f 26.48404 2.327738   22.80206     2.3   7.277459 1.232958          ?        ? 
1 1 1   15   32   15 o 26.21930 2.351241   27.00041   227.8   7.217315 1.232958          ?        ? 
1 1 1   15   32   16 o 11.43928 4.066644   17.95756   311.2   1.533679 1.172814          ?        ? 
1 1 1   15   33    0 f 126.3848 1.856839   107.4067    -0.0   160.1642 4.691255   160.1642 4.691255 
1 1 1   15   33    1 o 29.53124 2.393043   31.72559   135.3   8.781067 1.413391          ?        ? 
1 1 1   15   33    2 o 89.11758 1.349774   91.00934   244.0   79.60097 2.405771          ?        ? 
1 1 1   15   33    3 o 31.68031 2.183247   30.31583   189.7   10.10424 1.383319          ?        ? 
1 1 1   15   33    4 o 71.00145 1.185920   68.10971    25.8   50.52120 1.684040          ?        ? 
1 1 1   15   33    5 o 50.49186 1.280506   34.51030   201.8   25.56132 1.293102          ?        ? 
1 1 1   15   33    6 o 43.85067 1.371571   50.80013   186.8   19.30632 1.202886          ?        ? 
1 1 1   15   33    7 o 27.18745 1.990987   31.10226   161.9   7.457891 1.082597          ?        ? 
1 1 1   15   33    8 o 27.92001 1.992602   28.03008   101.0   7.878902 1.112669          ?        ? 
1 1 1   15   33    9 o 34.98655 1.547162   30.48734   352.1   12.32958 1.082597          ?        ? 
1 1 1   15   33   10 o 30.67056 1.666831   31.28188   124.8   9.502798 1.022453          ?        ? 
1 1 1   15   33   11 o 37.44335 1.606274   36.63357    71.3   14.19405 1.202886          ?        ? 
1 1 1   15   33   12 o 25.25594 2.024183   23.58267    96.3   6.525656 1.022453          ?        ? 
1 1 1   15   33   13 o 20.35731 2.658989   22.04635   190.5   4.330389 1.082597          ?        ? 
1 1 1   15   33   14 o 32.01152 1.784891   29.63830   131.9   10.52525 1.142741          ?        ? 
1 1 1   15   33   15 o 9.575631 3.927529   6.767581   270.5  0.6916593 1.202886          ?        ? 
1 1 1   15   34    0 o 90.74261 1.957290   70.09047   180.0   82.69839 3.548513   82.69839 3.548513 
1 1 1   15   34    1 o 98.92851 1.231113   84.61273    76.2   98.09534 2.435844          ?        ? 
1 1 1   15   34    2 o 61.68376 1.389436   59.44724    11.7   38.16155 1.714112          ?        ? 
1 1 1   15   34    3 o 61.54986 1.416888   60.66663    10.0   38.01119 1.744184          ?        ? 
1 1 1   15   34    4 o 34.96968 1.676901   33.98851   132.5   12.29951 1.172814          ?        ? 
1 1 1   15   34    5 o 76.85504 1.154288   69.92161    80.6   59.24213 1.774257          ?        ? 
1 1 1   15   34    6 o 33.42810 1.664272   24.20349   322.5   11.24698 1.112669          ?        ? 
1 1 1   15   34    7 o 43.94949 1.436911   48.28936   176.7   19.42661 1.263030          ?        ? 
1 1 1   15   34    8 o 48.11837 1.312420   52.48419   222.4   23.27584 1.263030          ?        ? 
1 1 1   15   34    9 o 9.531167 3.757511   8.656610   209.7  0.6014429 1.052525          ?        ? 
1 1 1   15   34   10 o 48.98648 1.289162   44.13793     6.6   24.17801 1.263030          ?        ? 
1 1 1   15   34   11 o 20.15913 2.610542   21.44390    32.5   4.210100 1.052525          ?        ? 
1 1 1   15   34   12 o 38.95267 1.544035   33.52568   248.9   15.39694 1.202886          ?        ? 
1 1 1   15   34   13 o 8.562828 3.659788   4.585741   165.6  0.1804329 1.112669          ?        ? 
1 1 1   15   34   14 o 22.01964 2.526538   19.91660    56.8   5.142337 1.112669          ?        ? 
1 1 1   15   34   15 o 24.69010 2.618666   22.32190    38.6   6.615872 1.293102          ?        ? 
1 1 1   15   35    0 o 7.625597 4.966475   16.05292   180.0       0.03 1.774257       0.03 1.774257 
1 1 1   15   35    1 o 38.42264 1.956668   48.98671   257.4   14.88571 1.503607          ?        ? 
1 1 1   15   35    2 o 43.73325 1.684685   30.32215   268.1   19.24617 1.473535          ?        ? 
1 1 1   15   35    3 o 34.99050 2.062650   25.78060   119.4   12.35965 1.443463          ?        ? 
1 1 1   15   35    4 o 27.98134 2.095707   20.99074   277.0   7.908974 1.172814          ?        ? 
1 1 1   15   35    5 o 26.48094 2.157668   30.28676   172.4   7.097026 1.142741          ?        ? 
1 1 1   15   35    6 o 9.326183 3.827129   3.908761   201.2  0.3608657 1.142741          ?        ? 
1 1 1   15   35    7 o 84.21893 1.178335   83.49632    76.0   71.24091 1.984761          ?        ? 
1 1 1   15   35    8 o 43.75317 1.374627   36.87783    26.8   19.27625 1.202886          ?        ? 
1 1 1   15   35    9 o 12.44895 3.970204   10.45397   339.0   1.653968 1.112669          ?        ? 
1 1 1   15   35   10 o 17.70797 3.264185   16.04246   176.8   3.398152 1.112669          ?        ? 
1 1 1   15   35   11 o 32.44693 1.899961   25.35615   206.5   10.76583 1.232958          ?        ? 
1 1 1   15   35   12 o 9.170273 3.802400   6.549391    61.4  0.4210100 1.142741          ?        ? 
1 1 1   15   35   13 o 43.89651 1.404392   43.00570   358.4   19.60704 1.232958          ?        ? 
1 1 1   15   35   14 o 21.66798 2.636936   22.57938    46.3   5.082192 1.142741          ?        ? 
1 1 1   15   36    0 o 11.70264 6.126591   4.082463   180.0   2.105050 1.864473   2.105050 1.864473 
1 1 1   15   36    1 o 55.76595 1.536881   59.03093   237.6   31.27503 1.714112          ?        ? 
1 1 1   15   36    2 o 50.66820 1.572805   51.07379   312.0   25.83197 1.593824          ?        ? 
1 1 1   15   36    3 o 74.32646 1.416084   62.85608   220.3   55.54325 2.105050          ?        ? 
1 1 1   15   36    4 o 23.91700 2.263238   26.74932   231.7   5.803924 1.082597          ?        ? 
1 1 1   15   36    5 o 12.35302 4.030099   19.86827   195.0   1.563751 1.142741          ?        ? 
1 1 1   15   36    6 o 32.05481 1.923203   18.36225   320.7   10.40496 1.232958          ?        ? 
1 1 1   15   36    7 o 37.73691 1.593779   19.77381   307.4   14.37449 1.202886          ?        ? 
1 1 1   15   36    8 o 36.26824 1.658318   36.88569   142.3   13.32196 1.202886          ?        ? 
1 1 1   15   36    9 o 13.39076 3.911650   18.08112   142.3   1.984761 1.112669          ?        ? 
1 1 1   15   36   10 o 53.83231 1.368634   50.68716   134.5   29.32034 1.473535          ?        ? 
1 1 1   15   36   11 o 10.25461 3.943959   19.63426   297.2  0.9021643 1.142741          ?        ? 
1 1 1   15   36   12 o 7.874495 3.482759   6.573390   262.3 -0.1202886 1.082597          ?        ? 
1 1 1   15   36   13 o 17.27355 3.339931   9.176741   286.9   3.428224 1.112669          ?        ? 
1 1 1   15   36   14 o 14.06999 4.053357   9.295036   352.1   2.495988 1.202886          ?        ? 
1 1 1   15   37    0 o 80.10627 1.860476   78.93788   180.0   64.59497 2.977142   64.59497 2.977142 
1 1 1   15   37    1 o 43.71692 1.719709   36.96019   270.1   19.27625 1.503607          ?        ? 
1 1 1   15   37    2 o 86.97265 1.400351   83.27618   105.2   76.08253 2.435844          ?        ? 
1 1 1   15   37    3 o 24.68792 2.618897   31.17976   115.9   6.224934 1.293102          ?        ? 
1 1 1   15   37    4 o 26.87199 2.182223   34.08100   258.0   7.337603 1.172814          ?        ? 
1 1 1   15   37    5 o 55.22363 1.361381   63.14957     9.6   30.70366 1.503607          ?        ? 
1 1 1   15   37    6 o 16.64888 3.538288   10.05864   320.6   3.007215 1.142741          ?        ? 
1 1 1   15   37    7 o 19.25893 3.044857   28.60999    54.2   3.879307 1.172814          ?        ? 
1 1 1   15   37    8 o 25.76053 2.334745   22.93425   276.4   6.826377 1.202886          ?        ? 
1 1 1   15   37    9 o 72.12817 1.250780   68.61536   228.8   52.53604 1.804329          ?        ? 
1 1 1   15   37   10 f 49.33754 1.401893   53.44110   285.0   24.65916 1.383319          ?        ? 
1 1 1   15   37   11 o 16.47276 3.569160   20.33564   265.4   3.097431 1.142741          ?        ? 
1 1 1   15   37   12 o 16.20307 3.777917   15.78879   150.4   3.097431 1.202886          ?        ? 
1 1 1   15   37   13 o 9.553319 3.860257   9.032224    39.3  0.7818757 1.142741          ?        ? 
1 1 1   15   38    0 o 36.85799 2.932769   34.31622   360.0   14.04369 2.135122   14.04369 2.135122 
1 1 1   15   38    1 o 63.20214 1.427427   62.64230   348.2   40.23653 1.804329          ?        ? 
1 1 1   15   38    2 o 18.97185 3.617083   13.25206    85.6   3.879307 1.323174          ?        ? 
1 1 1   15   38    3 o 68.98583 1.460324   60.09664   174.7   47.96507 2.014834          ?        ? 
1 1 1   15   38    4 o 23.88899 2.391775   20.75118   113.6   5.833996 1.142741          ?        ? 
1 1 1   15   38    5 o 32.14038 2.011648   33.70599   326.4   10.52525 1.293102          ?        ? 
1 1 1   15   38    6 o 7.441490 3.387651   14.27776   170.5 -0.5713707 1.112669          ?        ? 
1 1 1   15   38    7 o 7.553535 3.423173   5.703180    20.9 -0.4811543 1.112669          ?        ? 
1 1 1   15   38    8 o 52.98352 1.277045   58.23802   129.0   28.35803 1.353247          ?        ? 
1 1 1   15   38    9 o 15.15567 3.858221   9.169209    59.3   2.616277 1.172814          ?        ? 
1 1 1   15   38   10 o 30.77330 1.954431   29.61240   347.1   9.773447 1.202886          ?        ? 
1 1 1   15   38   11 o 20.83736 2.886368   21.81118   289.2   4.691255 1.202886          ?        ? 
1 1 1   15   38   12 o 24.92990 2.472850   23.13087   319.2   6.676016 1.232958          ?        ? 
1 1 1   15   39    0 o 12.15452 6.468648   27.79666   180.0   2.375700 2.105050   2.375700 2.105050 
1 1 1   15   39    1 o 25.31462 2.732252   21.47265    79.2   6.615872 1.383319          ?        ? 
1 1 1   15   39    2 o 40.30938 1.865084   41.83477   171.3   16.50961 1.503607          ?        ? 
1 1 1   15   39    3 o 35.32837 2.085484   35.46852    33.4   12.75059 1.473535          ?        ? 
1 1 1   15   39    4 o 30.06012 2.050820   21.68991   136.5   9.232149 1.232958          ?        ? 
1 1 1   15   39    5 o 12.97425 4.183504   5.349593   359.8   1.834401 1.232958          ?        ? 
1 1 1   15   39    6 o 30.01358 2.003903   31.81764   139.9   9.232149 1.202886          ?        ? 
1 1 1   15   39    7 o 31.91844 1.978527   38.04601   322.4   10.43503 1.263030          ?        ? 
1 1 1   15   39    8 o 23.91935 2.577323   18.31454   340.3   5.984357 1.232958          ?        ? 
1 1 1   15   39    9 o 20.24515 2.896530   18.73009   193.3   4.390533 1.172814          ?        ? 
1 1 1   15   39   10 f 12.60416 3.964258   11.20876   145.8   1.864473 1.112669          ?        ? 
1 1 1   15   39   11 o 9.999383 4.050987   4.620236    93.7  0.8720922 1.263030          ?        ? 
1 1 1   15   40    0 o 14.40224 6.431293   9.163532     0.0   3.247792 1.954689   3.247792 1.954689 
1 1 1   15   40    1 o 46.83420 1.669455   43.32088   185.3   22.25339 1.563751          ?        ? 
1 1 1   15   40    2 o 18.42410 4.105292   20.20801   319.3   3.819162 1.473535          ?        ? 
1 1 1   15   40    3 o 28.92238 2.495409   24.79478     7.1   8.660777 1.443463          ?        ? 
1 1 1   15   40    4 o 34.11956 1.806820   25.20562   244.9   11.87850 1.232958          ?        ? 
1 1 1   15   40    5 o 42.21345 1.602862   41.51816   171.8   18.10343 1.353247          ?        ? 
1 1 1   15   40    6 o 25.68673 2.458526   25.69204   242.5   6.856449 1.263030          ?        ? 
1 1 1   15   40    7 o 16.97387 3.567772   16.06728   126.8   3.247792 1.172814          ?        ? 
1 1 1   15   40    8 o 12.19198 4.134799   11.88888    14.5   1.684040 1.202886          ?        ? 
1 1 1   15   40    9 o 7.754934 3.528194   7.185906   180.5 -0.4210100 1.202886          ?        ? 
1 1 1   15   40   10 o 40.43646 1.673300   36.03802   263.6   16.90055 1.353247          ?        ? 
1 1 1   15   41    0 o 44.64709 2.508740   38.75326     0.0   20.50920 2.225339   20.50920 2.225339 
1 1 1   15   41    1 o 11.12498 4.395754   20.13972   112.8  0.9923807 1.443463          ?        ? 
1 1 1   15   41    2 o 17.77255 4.135019   10.72400    38.0   3.608657 1.443463          ?        ? 
1 1 1   15   41    3 o 17.51062 4.030849   16.58830    50.8   3.488369 1.383319          ?        ? 
1 1 1   15   41    4 o 28.79442 2.140967   17.75573   119.0   8.540489 1.232958          ?        ? 
1 1 1   15   41    5 o 31.74159 2.131662   34.69549   216.5   10.40496 1.353247          ?        ? 
1 1 1   15   41    6 o 26.43982 2.445369   33.34579   305.0   7.337603 1.293102          ?        ? 
1 1 1   15   41    7 o 33.72204 1.872707   36.44353   298.3   11.72814 1.263030          ?        ? 
1 1 1   15   41    8 o 26.37210 2.451648   20.57788   126.0   7.397748 1.293102          ?        ? 
1 1 1   15   41    9 o 13.28541 4.110574   12.62827    19.5   2.195267 1.202886          ?        ? 
1 1 1   15   42    0 o 38.47644 3.046496   33.46806   180.0   15.54730 2.315555   15.54730 2.315555 
1 1 1   15   42    1 o 38.47453 1.993110   28.28386    48.9   15.21651 1.533679          ?        ? 
1 1 1   15   42    2 o 24.45267 3.013035   12.87942   354.8   6.375295 1.473535          ?        ? 
1 1 1   15   42    3 o 17.45109 4.324521   17.82482   349.2   3.608657 1.503607          ?        ? 
1 1 1   15   42    4 o 27.32658 2.255968   19.84356    96.9   7.788685 1.232958          ?        ? 
1 1 1   15   42    5 o 8.849250 3.819034   3.685758   138.9  0.1804329 1.232958          ?        ? 
1 1 1   15   42    6 o 23.61228 2.547162   22.27430   307.9   5.924213 1.202886          ?        ? 
1 1 1   15   42    7 o 9.146422 3.878877   7.119648    25.3  0.4510822 1.232958          ?        ? 
1 1 1   15   42    8 o 22.77445 2.772909   24.62530    45.7   5.683635 1.263030          ?        ? 
1 1 1   15   43    0 o 10.84204 6.188608   23.44502   180.0   2.014834 2.074978   2.014834 2.074978 
1 1 1   15   43    1 o 21.71422 3.531509   18.99489   290.1   5.232553 1.533679          ?        ? 
1 1 1   15   43    2 o 14.77465 4.655659   12.55789   199.4   2.676421 1.533679          ?        ? 
1 1 1   15   43    3 o 22.69604 3.444987   10.76308   133.9   5.713707 1.563751          ?        ? 
1 1 1   15   43    4 o 13.42071 4.102116   11.69210   289.5   2.165194 1.202886          ?        ? 
1 1 1   15   43    5 o 25.57811 2.645322   21.66221   212.0   7.066954 1.353247          ?        ? 
1 1 1   15   43    6 o 20.58824 3.067358   24.35209   301.8   4.721327 1.263030          ?        ? 
1 1 1   15   43    7 o 15.38573 4.256796   19.32649    37.7   3.037287 1.353247          ?        ? 
1 1 1   15   44    0 o 28.60923 4.293185   24.26753     0.0   9.322365 2.345627   9.322365 2.345627 
1 1 1   15   44    1 o 14.25503 4.519568   9.843535    38.4   2.586205 1.443463          ?        ? 
1 1 1   15   44    2 o 19.10158 3.987295   19.47372   162.5   4.420605 1.473535          ?        ? 
1 1 1   15   44    3 o 13.44600 4.662961   8.996983   105.4   2.315555 1.533679          ?        ? 
1 1 1   15   44    4 o 40.80614 1.768684   33.43298   164.8   17.29148 1.443463          ?        ? 
1 1 1   15   44    5 o 9.866255 4.000243   6.056139   270.8  0.8720922 1.232958          ?        ? 
1 1 1   15   45    0 o 11.43106 6.344150   14.15453    -0.0   2.526060 2.105050   2.526060 2.105050 
1 1 1   15   45    1 o 16.03792 4.562972   14.20341    87.1   3.398152 1.533679          ?        ? 
1 1 1   15   45    2 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   16    0    0 o 393.8363 4.854139   350.7076   180.0   1552.294 38.22169   1552.294 38.22169 
1 1 1   16    0    1 o 217.8165 2.078256   295.0413   180.0   474.6287 9.051716   474.6287 9.051716 
1 1 1   16    0    2 o 188.5126 1.874814   132.3934   180.0   355.5129 7.066954   355.5129 7.066954 
1 1 1   16    0    3 o 292.1740 2.614777   424.3331   180.0   854.0489 15.27665   854.0489 15.27665 
1 1 1   16    0    4 o 363.9345 3.140490   395.8878   180.0   1325.279 22.85483   1325.279 22.85483 
1 1 1   16    0    5 o 294.1678 2.545902   313.2849   180.0   865.8071 14.97593   865.8071 14.97593 
1 1 1   16    0    6 o 19.25123 1.663965   70.62244   180.0   3.789090 0.6315150   3.789090 0.6315150 
1 1 1   16    0    7 o 108.2860 1.180584   176.8993   180.0   117.3114 2.556132   117.3114 2.556132 
1 1 1   16    0    8 o 32.73275 1.290560   14.29214   180.0   10.76583 0.8420200   10.76583 0.8420200 
1 1 1   16    0    9 o 111.2962 1.419062   86.49968     0.0   123.9574 3.157575   123.9574 3.157575 
1 1 1   16    0   10 o 54.98853 1.149568   87.91111     0.0   30.28265 1.263030   30.28265 1.263030 
1 1 1   16    0   11 o 42.33490 0.9600558   108.0284     0.0   17.95307 0.8119479   17.95307 0.8119479 
1 1 1   16    0   12 o 5.321449 3.200874   31.95837     0.0  0.3007214 0.6014429  0.3007214 0.6014429 
1 1 1   16    0   13 o 54.28120 0.9702038   42.07988   180.0   29.50077 1.052525   29.50077 1.052525 
1 1 1   16    0   14 o 114.2060 1.277436   167.6630     0.0   130.5432 2.916998   130.5432 2.916998 
1 1 1   16    0   15 o 26.27328 1.791000   40.04060   180.0   7.006810 0.9322364   7.006810 0.9322364 
1 1 1   16    0   16 o 93.01960 1.228976   120.8985   180.0   86.63785 2.285483   86.63785 2.285483 
1 1 1   16    0   17 o 12.40121 4.404034   39.29800   180.0   2.044906 0.9923807   2.044906 0.9923807 
1 1 1   16    0   18 f 27.59808 1.925815   44.97018   180.0   7.758613 1.052525   7.758613 1.052525 
1 1 1   16    0   19 o 12.69509 4.639907   12.53118   180.0   2.195267 1.082597   2.195267 1.082597 
1 1 1   16    0   20 o 30.86508 2.014899   34.10579     0.0   9.743376 1.232958   9.743376 1.232958 
1 1 1   16    0   21 o 11.89820 5.099926   15.45388     0.0   2.135122 1.232958   2.135122 1.232958 
1 1 1   16    0   22 o 9.888296 4.874043  0.1648606     0.0   1.593824 1.142741   1.593824 1.142741 
1 1 1   16    1    0 o 194.2752 1.966304   196.5171     0.0   377.5858 7.638325   377.5858 7.638325 
1 1 1   16    1    1 o 114.8696 0.9162784   173.2361   186.5   131.9566 2.105050          ?        ? 
1 1 1   16    1    2 o 196.0076 1.350126   181.9277    53.7   384.2318 5.292697          ?        ? 
1 1 1   16    1    3 o 120.5655 0.9478183   188.5013    66.1   145.3687 2.285483          ?        ? 
1 1 1   16    1    4 o 234.0676 1.522444   214.0283   163.7   547.9746 7.127099          ?        ? 
1 1 1   16    1    5 o 132.4705 0.9988445   183.9197   176.7   175.5010 2.646349          ?        ? 
1 1 1   16    1    6 o 218.0558 1.468744   233.5664   253.9   475.5910 6.405366          ?        ? 
1 1 1   16    1    7 o 48.27480 0.6540835   38.83817   189.9   23.30591 0.6315150          ?        ? 
1 1 1   16    1    8 o 106.5957 0.8886597   73.74722    71.0   113.6426 1.894545          ?        ? 
1 1 1   16    1    9 o 63.16338 1.023617   95.71444   206.2   39.90574 1.293102          ?        ? 
1 1 1   16    1   10 o 108.2354 1.125253   134.2579    59.9   117.1912 2.435844          ?        ? 
1 1 1   16    1   11 o 47.39259 0.6345326   78.74974    98.9   22.46389 0.6014429          ?        ? 
1 1 1   16    1   12 o 58.69958 0.6403824   79.22746   105.2   34.46268 0.7518036          ?        ? 
1 1 1   16    1   13 o 50.78869 0.6809186   64.68679   352.7   25.80190 0.6916593          ?        ? 
1 1 1   16    1   14 o 115.1553 0.9401194   114.1107    41.5   132.6783 2.165194          ?        ? 
1 1 1   16    1   15 o 84.11035 0.9117067   112.8509   285.7   70.78983 1.533679          ?        ? 
1 1 1   16    1   16 o 32.47183 1.018709   32.46329    79.7   10.55532 0.6615872          ?        ? 
1 1 1   16    1   17 o 89.80918 0.9710502   104.9139   239.7   80.77378 1.744184          ?        ? 
1 1 1   16    1   18 o 37.53775 1.161620   38.82748   240.3   14.13391 0.8720922          ?        ? 
1 1 1   16    1   19 o 21.98452 1.573060   37.15485   356.0   4.871688 0.6916593          ?        ? 
1 1 1   16    1   20 f 20.04647 1.875152   19.56456   285.5   4.089812 0.7518036          ?        ? 
1 1 1   16    1   21 o 9.227387 3.198882   16.93900   116.3  0.8420200 0.7217315          ?        ? 
1 1 1   16    1   22 o 14.40346 3.019731   13.92327   287.3   2.315555 0.8420200          ?        ? 
1 1 1   16    2    0 o 123.1310 1.441393   171.4957     0.0   151.6839 3.548513   151.6839 3.548513 
1 1 1   16    2    1 o 420.8737 2.572261   489.4787   357.7   1772.031 21.65195          ?        ? 
1 1 1   16    2    2 o 186.9383 1.359324   243.5693   254.8   349.4984 5.082192          ?        ? 
1 1 1   16    2    3 o 257.4589 1.658612   297.1123   154.9   662.9705 8.540489          ?        ? 
1 1 1   16    2    4 o 174.5434 1.240491   182.3163   101.3   304.6910 4.330389          ?        ? 
1 1 1   16    2    5 o 127.4263 0.9793851   133.1422     1.8   162.3896 2.495988          ?        ? 
1 1 1   16    2    6 o 189.3387 1.246794   270.5536    59.2   358.5502 4.721327          ?        ? 
1 1 1   16    2    7 o 337.9748 2.206641   372.0880   355.6   1143.042 14.91578          ?        ? 
1 1 1   16    2    8 o 122.9623 1.137223   152.9190   276.5   151.2328 2.796710          ?        ? 
1 1 1   16    2    9 o 159.5536 1.517238   183.7036   222.9   254.7111 4.841615          ?        ? 
1 1 1   16    2   10 o 91.58250 1.067174   92.69665   306.9   83.90128 1.954689          ?        ? 
1 1 1   16    2   11 o 43.99684 1.127787   84.97178    88.1   19.36646 0.9923807          ?        ? 
1 1 1   16    2   12 o 105.3515 1.156056   112.8818   159.2   111.0564 2.435844          ?        ? 
1 1 1   16    2   13 o 67.37600 0.7141331   83.94172   279.7   45.40894 0.9623086          ?        ? 
1 1 1   16    2   14 o 80.93078 0.8546308   80.05558   141.7   65.52720 1.383319          ?        ? 
1 1 1   16    2   15 o 13.07427 2.504428   2.324760   292.4   1.774257 0.6315150          ?        ? 
1 1 1   16    2   16 o 23.94045 1.444541   19.34468    68.6   5.743780 0.6916593          ?        ? 
1 1 1   16    2   17 o 66.49098 0.9045482   73.26127   276.7   44.26620 1.202886          ?        ? 
1 1 1   16    2   18 o 48.86506 1.046201   62.24782   288.8   23.93743 1.022453          ?        ? 
1 1 1   16    2   19 o 30.10967 1.248442   36.25157     0.9   9.111859 0.7518036          ?        ? 
1 1 1   16    2   20 o 78.51337 0.9383976   92.97746    76.2   61.91854 1.473535          ?        ? 
1 1 1   16    2   21 o 19.90928 1.963596   22.49312    94.4   4.059740 0.7818757          ?        ? 
1 1 1   16    2   22 o 13.87584 3.111358   8.326106   204.1   2.165194 0.8420200          ?        ? 
1 1 1   16    3    0 o 373.0502 3.289525   352.6577     0.0   1392.430 24.53887   1392.430 24.53887 
1 1 1   16    3    1 o 257.0099 1.702462   343.4508   327.4   660.6549 8.750995          ?        ? 
1 1 1   16    3    2 o 246.8183 1.620461   298.6170   288.8   609.2917 7.999191          ?        ? 
1 1 1   16    3    3 o 217.0139 1.482725   255.7556   262.6   471.0200 6.435439          ?        ? 
1 1 1   16    3    4 o 274.4346 1.769694   346.7217     3.1   753.3373 9.713303          ?        ? 
1 1 1   16    3    5 o 177.2334 1.238631   229.1876   326.0   314.1637 4.390533          ?        ? 
1 1 1   16    3    6 o 181.9242 1.405053   253.1630    38.3   331.0342 5.112265          ?        ? 
1 1 1   16    3    7 o 245.6621 1.823948   289.3082   159.2   603.7885 8.961499          ?        ? 
1 1 1   16    3    8 o 94.27396 1.036707   113.6695    98.7   88.89326 1.954689          ?        ? 
1 1 1   16    3    9 o 96.17799 1.156886   86.41339    77.1   92.53199 2.225339          ?        ? 
1 1 1   16    3   10 o 127.5674 1.249398   154.2995   263.3   162.8106 3.187647          ?        ? 
1 1 1   16    3   11 o 24.20252 1.677403   31.97382    55.7   5.864068 0.8119479          ?        ? 
1 1 1   16    3   12 o 64.86738 1.089446   102.8837   200.8   42.10100 1.413391          ?        ? 
1 1 1   16    3   13 o 22.73532 1.058165   70.06828   345.2   5.172409 0.4811543          ?        ? 
1 1 1   16    3   14 o 50.99300 0.7666500   79.28283   350.2   26.01241 0.7818757          ?        ? 
1 1 1   16    3   15 o 41.78633 0.8995807   48.37182   137.6   17.47192 0.7518036          ?        ? 
1 1 1   16    3   16 f 102.8099 0.9213823   102.7962   354.1   105.7938 1.894545          ?        ? 
1 1 1   16    3   17 o 34.99417 1.117151   32.28915    86.4   12.26943 0.7818757          ?        ? 
1 1 1   16    3   18 o 55.29578 0.9789149   66.93131    71.7   30.64352 1.082597          ?        ? 
1 1 1   16    3   19 o 33.09966 1.181094   43.29121   328.0   11.00640 0.7818757          ?        ? 
1 1 1   16    3   20 o 41.77465 1.115792   54.71063    82.1   17.56213 0.9322364          ?        ? 
1 1 1   16    3   21 o 9.250363 3.317196   9.359930    54.1  0.8119479 0.7818757          ?        ? 
1 1 1   16    3   22 o 13.48724 3.076942   10.98886    44.8   2.044906 0.8119479          ?        ? 
1 1 1   16    4    0 o 391.2168 5.055980   422.2305   180.0   1532.446 39.54487   1532.446 39.54487 
1 1 1   16    4    1 o 257.1690 1.853426   294.7718   157.0   661.4969 9.532870          ?        ? 
1 1 1   16    4    2 o 104.0738 0.9535354   191.3049    94.6   108.3199 1.984761          ?        ? 
1 1 1   16    4    3 o 107.4985 0.9930944   169.3145   217.4   115.5672 2.135122          ?        ? 
1 1 1   16    4    4 o 228.9563 1.681210   253.5567   278.0   524.3379 7.698469          ?        ? 
1 1 1   16    4    5 o 199.5696 1.469179   277.1055   205.6   398.3657 5.864068          ?        ? 
1 1 1   16    4    6 o 202.1946 1.450105   281.2906     9.1   408.9211 5.864068          ?        ? 
1 1 1   16    4    7 o 60.26745 0.9979564   77.83035   219.5   36.32715 1.202886          ?        ? 
1 1 1   16    4    8 f 69.98535 0.9453225   79.48154   322.1   48.98752 1.323174          ?        ? 
1 1 1   16    4    9 o 111.0626 1.096608   153.7187   186.3   123.3860 2.435844          ?        ? 
1 1 1   16    4   10 o 84.28124 1.106102   140.6914   308.2   71.06048 1.864473          ?        ? 
1 1 1   16    4   11 o 116.5732 1.289839   123.5854   235.1   135.9862 3.007215          ?        ? 
1 1 1   16    4   12 o 139.6544 1.550394   184.1480   319.2   195.2584 4.330389          ?        ? 
1 1 1   16    4   13 o 113.9332 1.451700   124.5270   262.8   129.9718 3.307936          ?        ? 
1 1 1   16    4   14 o 52.59024 0.7147748   75.24860    65.5   27.66637 0.7518036          ?        ? 
1 1 1   16    4   15 o 57.02800 0.7909836   65.63052    79.7   32.53806 0.9021643          ?        ? 
1 1 1   16    4   16 o 68.02296 0.8841764   77.39740   356.9   46.31110 1.202886          ?        ? 
1 1 1   16    4   17 o 68.38431 0.9014919   68.07616   247.9   46.82233 1.232958          ?        ? 
1 1 1   16    4   18 o 16.63975 2.078335   18.17134   262.9   2.796710 0.6916593          ?        ? 
1 1 1   16    4   19 o 31.65179 1.282626   28.39030   281.6   10.07417 0.8119479          ?        ? 
1 1 1   16    4   20 o 16.70299 2.160487   16.85072   324.6   2.856854 0.7217315          ?        ? 
1 1 1   16    4   21 f 18.28849 2.302050   14.71605   283.6   3.458297 0.8420200          ?        ? 
1 1 1   16    4   22 o 7.133607 3.089138   5.862544   142.1       0.03 0.8119479          ?        ? 
1 1 1   16    5    0 o 245.5773 2.290354   291.7001   180.0   603.3375 11.24698   603.3375 11.24698 
1 1 1   16    5    1 o 203.2364 1.398282   236.7312   294.0   413.1010 5.683635          ?        ? 
1 1 1   16    5    2 f 311.8268 2.136116   254.6539   101.8   972.6534 13.32196          ?        ? 
1 1 1   16    5    3 o 114.0402 1.028422   167.0114    51.0   130.0620 2.345627          ?        ? 
1 1 1   16    5    4 o 109.0801 0.9924787   152.7672     7.0   118.9955 2.165194          ?        ? 
1 1 1   16    5    5 f 256.7622 1.791945   348.0978   239.0   659.4821 9.202076          ?        ? 
1 1 1   16    5    6 o 127.1499 1.206198   219.9392   255.5   161.6979 3.067359          ?        ? 
1 1 1   16    5    7 f 111.0406 1.137449   225.5361   258.1   123.3259 2.526060          ?        ? 
1 1 1   16    5    8 o 162.8869 1.393880   183.5137   354.9   265.4167 4.540894          ?        ? 
1 1 1   16    5    9 o 89.61144 1.006751   133.9058    87.6   80.32270 1.804329          ?        ? 
1 1 1   16    5   10 o 63.77251 1.178883   65.79652   334.9   40.68761 1.503607          ?        ? 
1 1 1   16    5   11 o 33.96736 1.416520   32.13071   181.3   11.54770 0.9623086          ?        ? 
1 1 1   16    5   12 f 73.93178 1.260942   87.48387   272.5   54.70123 1.864473          ?        ? 
1 1 1   16    5   13 o 50.11983 1.170010   67.34122   273.9   25.14031 1.172814          ?        ? 
1 1 1   16    5   14 o 91.06626 0.8420679   116.6106   299.5   82.96905 1.533679          ?        ? 
1 1 1   16    5   15 o 50.24551 0.8379058   55.24162   343.1   25.26060 0.8420200          ?        ? 
1 1 1   16    5   16 f 19.74000 1.675753   8.610580   318.0   3.909379 0.6615872          ?        ? 
1 1 1   16    5   17 o 17.19174 2.186527   8.828048   114.1   2.977142 0.7518036          ?        ? 
1 1 1   16    5   18 o 66.80290 0.9228327   76.54461   283.2   44.71728 1.232958          ?        ? 
1 1 1   16    5   19 o 38.53505 1.131557   39.47704   327.7   14.91578 0.8720922          ?        ? 
1 1 1   16    5   20 o 8.868411 3.186380   8.993871    60.9  0.7217315 0.7217315          ?        ? 
1 1 1   16    5   21 o 7.648913 3.190423   2.763009   325.1  0.2105050 0.8119479          ?        ? 
1 1 1   16    5   22 o 18.61885 2.261204   23.48570   139.9   3.638730 0.8420200          ?        ? 
1 1 1   16    6    0 o 148.8514 1.828972   199.4240   180.0   221.6918 5.443058   221.6918 5.443058 
1 1 1   16    6    1 o 126.0860 1.180600   146.2493   250.7   158.9914 2.977142          ?        ? 
1 1 1   16    6    2 o 133.5896 1.136798   91.33334    14.6   178.4782 3.037287          ?        ? 
1 1 1   16    6    3 o 374.0168 2.464358   435.5676   332.3   1399.588 18.43423          ?        ? 
1 1 1   16    6    4 o 219.4964 1.609811   251.8333     0.2   481.9061 7.066954          ?        ? 
1 1 1   16    6    5 o 123.4570 1.108307   175.0642    34.6   152.4357 2.736565          ?        ? 
1 1 1   16    6    6 o 151.4774 1.419458   161.8066   278.6   229.5106 4.300317          ?        ? 
1 1 1   16    6    7 o 122.9237 1.247667   196.2352   262.0   151.1426 3.067359          ?        ? 
1 1 1   16    6    8 f 83.33827 1.028406   141.0610   100.4   69.46665 1.714112          ?        ? 
1 1 1   16    6    9 o 90.27972 1.015954   117.9704    91.3   81.52559 1.834401          ?        ? 
1 1 1   16    6   10 o 73.92491 1.118681   77.01439   127.4   54.67116 1.653968          ?        ? 
1 1 1   16    6   11 o 53.99504 1.113885   74.75233   336.2   29.16998 1.202886          ?        ? 
1 1 1   16    6   12 o 19.27807 2.651855   28.38246   236.4   3.728946 1.022453          ?        ? 
1 1 1   16    6   13 o 86.15985 1.308853   96.37009   227.4   74.30827 2.255411          ?        ? 
1 1 1   16    6   14 o 33.68172 1.741024   34.24434   349.7   11.36727 1.172814          ?        ? 
1 1 1   16    6   15 o 62.40879 0.8673434   87.23814   261.8   38.97350 1.082597          ?        ? 
1 1 1   16    6   16 o 55.35835 0.8691632   61.77615   315.9   30.67359 0.9623086          ?        ? 
1 1 1   16    6   17 o 54.19817 0.8877686   68.13896    64.6   29.41056 0.9623086          ?        ? 
1 1 1   16    6   18 o 73.26999 0.9234657   71.61848   217.5   53.79906 1.353247          ?        ? 
1 1 1   16    6   19 o 24.06461 1.437088   35.61227    97.0   5.833996 0.6916593          ?        ? 
1 1 1   16    6   20 o 11.42764 3.697034   10.49322   239.8   1.383319 0.9623086          ?        ? 
1 1 1   16    6   21 o 18.09018 2.909106   28.34982   169.6   3.458297 1.052525          ?        ? 
1 1 1   16    6   22 o 7.281727 3.269736   7.120222   134.8 -0.2405772 0.9923807          ?        ? 
1 1 1   16    7    0 o 131.8022 1.654753   208.5596     0.0   173.8170 4.360461   173.8170 4.360461 
1 1 1   16    7    1 o 305.2614 2.216537   385.1866    25.4   932.1763 13.53246          ?        ? 
1 1 1   16    7    2 o 110.8566 1.152900   197.6073    17.0   122.9049 2.556132          ?        ? 
1 1 1   16    7    3 o 95.12004 1.043293   40.49111   236.8   90.48708 1.984761          ?        ? 
1 1 1   16    7    4 o 166.2625 1.365579   232.4245   289.0   276.4833 4.540894          ?        ? 
1 1 1   16    7    5 o 146.5927 1.169302   216.2895   220.5   214.9256 3.428224          ?        ? 
1 1 1   16    7    6 o 35.45234 0.9330657   38.35817   307.3   12.57016 0.6615872          ?        ? 
1 1 1   16    7    7 o 168.7155 1.622000   210.4306     9.7   284.7832 5.473131          ?        ? 
1 1 1   16    7    8 o 102.0182 1.238044   81.83844   152.5   104.1098 2.526060          ?        ? 
1 1 1   16    7    9 o 48.20525 1.185287   70.99231   117.8   23.24577 1.142741          ?        ? 
1 1 1   16    7   10 o 145.7237 1.558049   209.3170   214.2   212.5199 4.540894          ?        ? 
1 1 1   16    7   11 o 40.94753 1.395373   60.18906   196.0   16.78026 1.142741          ?        ? 
1 1 1   16    7   12 o 89.31979 1.279382   103.9812   291.4   79.84155 2.285483          ?        ? 
1 1 1   16    7   13 o 35.04041 1.759337   60.84810    42.7   12.29951 1.232958          ?        ? 
1 1 1   16    7   14 o 55.97269 1.316298   81.42001   296.8   31.36525 1.473535          ?        ? 
1 1 1   16    7   15 o 22.85885 1.249780   15.46160   312.4   5.232553 0.5713707          ?        ? 
1 1 1   16    7   16 o 35.25985 1.066090   36.54847   283.6   12.44987 0.7518036          ?        ? 
1 1 1   16    7   17 o 66.10151 0.9098776   66.11972    48.5   43.75497 1.202886          ?        ? 
1 1 1   16    7   18 o 37.86280 1.350208   41.52098   101.8   14.40456 1.022453          ?        ? 
1 1 1   16    7   19 o 17.23417 3.077199   20.41440   274.5   3.157575 1.022453          ?        ? 
1 1 1   16    7   20 o 29.26954 1.849358   28.38862   258.6   8.720922 1.082597          ?        ? 
1 1 1   16    7   21 o 6.211609 2.917148   6.703819   103.1 -0.8720922 0.9322364          ?        ? 
1 1 1   16    7   22 f 26.08858 2.190119   28.08252   309.5   7.157170 1.142741          ?        ? 
1 1 1   16    8    0 o 115.4778 1.758714   73.85501   180.0   133.4602 4.059740   133.4602 4.059740 
1 1 1   16    8    1 o 196.7629 1.620045   216.9022   335.1   387.2390 6.375295          ?        ? 
1 1 1   16    8    2 o 267.8498 2.054585   306.6832   334.0   717.7018 11.00640          ?        ? 
1 1 1   16    8    3 o 89.75209 1.072185   159.3097    13.4   80.56327 1.924617          ?        ? 
1 1 1   16    8    4 o 222.2057 1.732284   246.7167   110.9   493.9049 7.698469          ?        ? 
1 1 1   16    8    5 o 111.9225 0.9941423   110.1923    77.8   125.2806 2.225339          ?        ? 
1 1 1   16    8    6 o 67.40519 0.8030518   64.15572   233.6   45.43901 1.082597          ?        ? 
1 1 1   16    8    7 o 128.0926 1.373397   164.7439    73.8   164.1338 3.518441          ?        ? 
1 1 1   16    8    8 f 218.7966 1.889847   272.8986    47.6   479.1094 8.269840          ?        ? 
1 1 1   16    8    9 o 109.7212 1.260758   121.6397    64.5   120.4389 2.766637          ?        ? 
1 1 1   16    8   10 o 84.63479 1.154779   113.5251   345.1   71.66192 1.954689          ?        ? 
1 1 1   16    8   11 o 33.69512 1.740332   73.06758   341.0   11.36727 1.172814          ?        ? 
1 1 1   16    8   12 o 79.11083 1.349450   130.4403     8.3   62.64028 2.135122          ?        ? 
1 1 1   16    8   13 o 8.015805 3.557504   9.891098   121.7 -0.4210100 1.142741          ?        ? 
1 1 1   16    8   14 o 58.84813 1.354184   76.68485    18.2   34.67318 1.593824          ?        ? 
1 1 1   16    8   15 o 61.26751 0.8098752   76.47359    24.7   37.56011 0.9923807          ?        ? 
1 1 1   16    8   16 o 24.95435 1.928138   28.60735   254.6   6.255006 0.9623086          ?        ? 
1 1 1   16    8   17 f 21.94540 2.466569   36.74589   125.3   4.871688 1.082597          ?        ? 
1 1 1   16    8   18 o 35.00438 1.503419   48.63044    91.8   12.32958 1.052525          ?        ? 
1 1 1   16    8   19 o 13.81445 3.724384   11.69437   202.5   2.074978 1.052525          ?        ? 
1 1 1   16    8   20 o 47.67334 1.324671   46.72475   237.2   22.94505 1.263030          ?        ? 
1 1 1   16    8   21 o 35.46465 1.695894   40.92661   241.2   12.84081 1.202886          ?        ? 
1 1 1   16    8   22 o 15.88537 3.586830   26.76609   202.4   2.977142 1.112669          ?        ? 
1 1 1   16    9    0 o 85.82407 1.542842   30.58657   360.0   73.73690 2.646349   73.73690 2.646349 
1 1 1   16    9    1 o 65.45873 1.056634   131.1485    12.9   42.85281 1.383319          ?        ? 
1 1 1   16    9    2 o 181.7669 1.497263   117.6844   267.3   330.4628 5.443058          ?        ? 
1 1 1   16    9    3 o 102.9378 1.080915   157.0829   264.5   105.9742 2.225339          ?        ? 
1 1 1   16    9    4 o 117.4284 1.062770   164.7570   321.0   137.9109 2.495988          ?        ? 
1 1 1   16    9    5 o 142.7672 1.158507   143.4210   154.5   203.8591 3.307936          ?        ? 
1 1 1   16    9    6 o 78.93150 0.8572284   91.14500   317.4   62.30948 1.353247          ?        ? 
1 1 1   16    9    7 o 116.1289 1.333617   131.3704    18.4   134.9036 3.097431          ?        ? 
1 1 1   16    9    8 o 110.3904 1.307598   127.3369   348.4   121.9125 2.886926          ?        ? 
1 1 1   16    9    9 o 283.5776 2.439048   387.0652   256.4   805.6027 13.83319          ?        ? 
1 1 1   16    9   10 o 73.65672 1.163582   112.6940   318.9   54.28022 1.714112          ?        ? 
1 1 1   16    9   11 o 43.91872 1.472154   71.29711   342.3   19.30632 1.293102          ?        ? 
1 1 1   16    9   12 o 116.2920 1.422254   149.2461    50.8   135.3848 3.307936          ?        ? 
1 1 1   16    9   13 o 104.6954 1.407450   174.8579   358.3   109.7333 2.947070          ?        ? 
1 1 1   16    9   14 o 71.28848 1.328788   95.88927     9.8   50.88207 1.894545          ?        ? 
1 1 1   16    9   15 o 71.33263 1.096098   85.70024   124.4   50.94221 1.563751          ?        ? 
1 1 1   16    9   16 o 46.32447 1.265869   51.95395    97.6   21.50158 1.172814          ?        ? 
1 1 1   16    9   17 o 24.40406 2.156455   32.09684    73.8   6.014429 1.052525          ?        ? 
1 1 1   16    9   18 o 15.39203 3.229153   27.85590   351.8   2.526060 0.9623086          ?        ? 
1 1 1   16    9   19 o 10.68967 3.694911   17.60896   151.2   1.112669 0.9623086          ?        ? 
1 1 1   16    9   20 o 30.80923 1.854544   28.53366    82.1   9.683230 1.142741          ?        ? 
1 1 1   16    9   21 o 11.20962 3.963411   15.09664    13.3   1.323174 1.112669          ?        ? 
1 1 1   16    9   22 o 16.55644 3.386320   13.94283   277.3   3.187647 1.082597          ?        ? 
1 1 1   16   10    0 o 71.27909 1.520355   61.15973   180.0   50.88207 2.165194   50.88207 2.165194 
1 1 1   16   10    1 o 401.6746 2.871147   409.8492   200.9   1614.724 23.06533          ?        ? 
1 1 1   16   10    2 o 129.0871 1.223040   117.2299   117.6   166.6598 3.157575          ?        ? 
1 1 1   16   10    3 o 27.47070 1.477844   21.99326    91.7   7.548109 0.8119479          ?        ? 
1 1 1   16   10    4 o 232.6254 1.719328   341.0793    61.8   541.3287 7.999191          ?        ? 
1 1 1   16   10    5 o 69.16614 0.8695627   84.29158   292.0   47.84478 1.202886          ?        ? 
1 1 1   16   10    6 o 155.0543 1.260648   204.5533   344.9   240.4869 3.909379          ?        ? 
1 1 1   16   10    7 o 140.2497 1.265069   165.2592   350.0   196.7620 3.548513          ?        ? 
1 1 1   16   10    8 o 169.5721 1.587205   225.9879   163.8   287.7303 5.382914          ?        ? 
1 1 1   16   10    9 o 70.06280 1.115964   104.3484    67.9   49.10781 1.563751          ?        ? 
1 1 1   16   10   10 o 86.47200 1.199798   105.7949    46.4   74.81950 2.074978          ?        ? 
1 1 1   16   10   11 o 43.36401 1.525659   76.93690   296.9   18.82516 1.323174          ?        ? 
1 1 1   16   10   12 o 26.32347 2.056334   34.57863   260.9   6.946666 1.082597          ?        ? 
1 1 1   16   10   13 o 40.45137 1.635513   38.56344   279.8   16.38932 1.323174          ?        ? 
1 1 1   16   10   14 o 61.34229 1.372658   71.83144   113.0   37.68040 1.684040          ?        ? 
1 1 1   16   10   15 o 54.31153 1.079710   42.57089   293.3   29.53085 1.172814          ?        ? 
1 1 1   16   10   16 o 43.61856 1.240982   56.00836   166.2   19.06574 1.082597          ?        ? 
1 1 1   16   10   17 o 23.25547 2.327619   39.03722   256.2   5.473131 1.082597          ?        ? 
1 1 1   16   10   18 o 10.56596 3.690783   7.288051   157.3   1.052525 0.9623086          ?        ? 
1 1 1   16   10   19 o 23.42499 2.182398   19.77576   289.0   5.593419 1.022453          ?        ? 
1 1 1   16   10   20 f 7.105771 3.274338   8.746198   211.3 -0.6916593 1.082597          ?        ? 
1 1 1   16   10   21 o 15.12013 3.784183   13.60132   177.1   2.646349 1.142741          ?        ? 
1 1 1   16   10   22 o 7.042130 3.300821   15.89185   283.8 -0.8119479 1.172814          ?        ? 
1 1 1   16   11    0 o 417.5021 4.149775   502.9743   180.0   1745.117 34.64311   1745.117 34.64311 
1 1 1   16   11    1 o 72.08219 1.084700   114.3426   163.9   51.96467 1.563751          ?        ? 
1 1 1   16   11    2 o 6.032222 2.758315   29.57013    32.4 -0.5412986 0.7518036          ?        ? 
1 1 1   16   11    3 o 139.9707 1.213880   195.2398    42.9   195.9501 3.398152          ?        ? 
1 1 1   16   11    4 o 74.72444 0.9457353   60.64817    30.5   55.84397 1.413391          ?        ? 
1 1 1   16   11    5 o 254.9537 1.816451   290.4506    95.4   650.3702 9.262220          ?        ? 
1 1 1   16   11    6 o 111.4862 1.078955   145.9978   358.1   124.3182 2.405771          ?        ? 
1 1 1   16   11    7 o 135.4313 1.132441   193.8061   321.2   183.4702 3.067359          ?        ? 
1 1 1   16   11    8 o 34.49835 1.525472   21.46428   267.1   11.90857 1.052525          ?        ? 
1 1 1   16   11    9 o 125.8746 1.373707   151.9798   191.7   158.5403 3.458297          ?        ? 
1 1 1   16   11   10 o 154.7346 1.574208   215.4950   170.7   239.6750 4.871688          ?        ? 
1 1 1   16   11   11 o 35.22393 1.451361   38.81491   169.4   12.41980 1.022453          ?        ? 
1 1 1   16   11   12 o 97.07256 1.378567   101.7974   264.7   94.33632 2.676421          ?        ? 
1 1 1   16   11   13 o 87.82867 1.318223   96.73245   151.6   77.22527 2.315555          ?        ? 
1 1 1   16   11   14 o 5.817509 2.555125   17.52066   165.6 -0.1503607 0.5713707          ?        ? 
1 1 1   16   11   15 o 34.73904 1.298488   59.31160   329.1   12.08900 0.9021643          ?        ? 
1 1 1   16   11   16 o 58.49653 1.105281   76.39449   348.1   34.28225 1.293102          ?        ? 
1 1 1   16   11   17 o 30.18282 1.743583   32.24472   145.8   9.172004 1.052525          ?        ? 
1 1 1   16   11   18 o 19.57026 2.612262   20.04951   164.6   3.909379 1.022453          ?        ? 
1 1 1   16   11   19 o 16.06644 3.295320   20.38815   206.9   2.796710 1.022453          ?        ? 
1 1 1   16   11   20 o 30.74050 1.711952   28.77770   129.1   9.623086 1.052525          ?        ? 
1 1 1   16   11   21 o 9.633245 3.873582   7.472069   126.0  0.6916593 1.142741          ?        ? 
1 1 1   16   11   22 o 7.195086 3.333946   5.121639   184.0 -0.6014429 1.142741          ?        ? 
1 1 1   16   12    0 o 369.4471 3.749231   418.6463     0.0   1366.358 27.69645   1366.358 27.69645 
1 1 1   16   12    1 o 125.1116 1.249885   164.1570   149.2   156.5556 3.127503          ?        ? 
1 1 1   16   12    2 o 104.7598 1.176938   105.0795   115.8   109.7633 2.465916          ?        ? 
1 1 1   16   12    3 o 315.2923 2.179402   343.0290   215.4   994.6963 13.74297          ?        ? 
1 1 1   16   12    4 f 132.6312 1.235706   166.2071   339.5   175.9521 3.277864          ?        ? 
1 1 1   16   12    5 o 71.40880 1.052817   81.74870   110.6   51.00236 1.503607          ?        ? 
1 1 1   16   12    6 o 236.0831 1.847003   278.2765   235.8   557.7180 8.720922          ?        ? 
1 1 1   16   12    7 o 86.38078 1.096624   84.88097   342.8   74.63906 1.894545          ?        ? 
1 1 1   16   12    8 o 108.1222 1.154245   126.4987   352.3   116.9506 2.495988          ?        ? 
1 1 1   16   12    9 o 102.0776 1.310974   143.5538    15.3   104.2601 2.676421          ?        ? 
1 1 1   16   12   10 o 59.01866 1.248364   85.39175   201.1   34.85361 1.473535          ?        ? 
1 1 1   16   12   11 o 92.91867 1.197466   103.6607   233.2   86.39727 2.225339          ?        ? 
1 1 1   16   12   12 o 42.48537 1.521821   55.37496   209.4   18.07336 1.293102          ?        ? 
1 1 1   16   12   13 o 33.30171 0.9481721   44.92713    19.3   11.09662 0.6315150          ?        ? 
1 1 1   16   12   14 o 113.7273 1.176683   135.7372   182.8   129.4907 2.676421          ?        ? 
1 1 1   16   12   15 o 96.66797 1.119913   112.6888   140.0   93.58452 2.165194          ?        ? 
1 1 1   16   12   16 o 79.68947 1.150968   89.60844    59.5   63.63266 1.834401          ?        ? 
1 1 1   16   12   17 o 15.02653 3.383595   4.766840   336.8   2.405771 0.9923807          ?        ? 
1 1 1   16   12   18 o 24.08052 2.247869   27.14959     3.8   5.894140 1.082597          ?        ? 
1 1 1   16   12   19 o 17.34954 3.414937   25.01900   221.1   3.277864 1.142741          ?        ? 
1 1 1   16   12   20 o 51.58821 1.282439   56.72694    10.7   26.88450 1.323174          ?        ? 
1 1 1   16   12   21 o 13.32167 3.918126   17.61382   262.7   2.074978 1.112669          ?        ? 
1 1 1   16   12   22 o 9.584422 3.928728   8.156700   344.3  0.7518036 1.202886          ?        ? 
1 1 1   16   13    0 o 70.49522 1.494540   52.31758   180.0   49.76940 2.105050   49.76940 2.105050 
1 1 1   16   13    1 o 169.6842 1.710214   209.0225   177.2   288.0310 5.803924          ?        ? 
1 1 1   16   13    2 o 230.1762 1.953193   316.8741   179.5   530.0817 8.991571          ?        ? 
1 1 1   16   13    3 o 171.8559 1.583611   194.2513   214.5   295.4588 5.443058          ?        ? 
1 1 1   16   13    4 o 163.7977 1.432027   136.1206   155.5   268.3939 4.691255          ?        ? 
1 1 1   16   13    5 o 99.12135 1.183210   140.5062   123.1   98.27576 2.345627          ?        ? 
1 1 1   16   13    6 o 131.9525 1.264852   108.9340   190.2   174.1779 3.338008          ?        ? 
1 1 1   16   13    7 o 147.9370 1.351790   170.1283   172.3   218.9553 3.999595          ?        ? 
1 1 1   16   13    8 o 189.9743 1.582959   215.8737   262.4   361.1965 6.014429          ?        ? 
1 1 1   16   13    9 o 49.19190 0.9781171   65.45911    14.0   24.20808 0.9623086          ?        ? 
1 1 1   16   13   10 o 97.92524 1.243726   128.3203    93.2   95.96021 2.435844          ?        ? 
1 1 1   16   13   11 o 87.03756 1.174726   111.8084   252.5   75.81188 2.044906          ?        ? 
1 1 1   16   13   12 o 48.52334 1.549365   60.72076   163.9   23.57656 1.503607          ?        ? 
1 1 1   16   13   13 o 45.43885 0.9596330   67.60239    88.1   20.65956 0.8720922          ?        ? 
1 1 1   16   13   14 o 74.50961 1.049362   98.64764    67.4   55.57333 1.563751          ?        ? 
1 1 1   16   13   15 o 36.54047 1.357920   52.49325   140.0   13.38210 0.9923807          ?        ? 
1 1 1   16   13   16 o 17.75436 2.625374   24.83989   155.7   3.187647 0.9322364          ?        ? 
1 1 1   16   13   17 o 20.94096 2.441276   17.29020   297.8   4.450677 1.022453          ?        ? 
1 1 1   16   13   18 o 30.64875 1.815196   38.69995   107.7   9.502798 1.112669          ?        ? 
1 1 1   16   13   19 o 19.31822 3.035512   22.25829   107.4   3.909379 1.172814          ?        ? 
1 1 1   16   13   20 o 10.14011 3.934797   15.59453   273.7  0.8420200 1.142741          ?        ? 
1 1 1   16   13   21 o 27.06109 2.055847   30.44928   162.1   7.608253 1.112669          ?        ? 
1 1 1   16   14    0 o 34.48079 2.737439   39.95378     0.0   12.11907 1.864473   12.11907 1.864473 
1 1 1   16   14    1 o 161.6963 1.887688   137.4967    49.8   261.5976 6.104645          ?        ? 
1 1 1   16   14    2 o 132.1744 1.308233   112.2520   258.2   174.7492 3.458297          ?        ? 
1 1 1   16   14    3 o 129.1822 1.303617   154.3998   204.1   166.9305 3.368080          ?        ? 
1 1 1   16   14    4 o 186.6374 1.635429   181.5542   310.1   348.5061 6.104645          ?        ? 
1 1 1   16   14    5 o 55.13216 1.090911   100.4166   242.5   30.40294 1.202886          ?        ? 
1 1 1   16   14    6 o 107.7210 1.172502   79.82404   122.6   116.0785 2.526060          ?        ? 
1 1 1   16   14    7 o 113.4132 1.193200   143.6362   185.4   128.6787 2.706493          ?        ? 
1 1 1   16   14    8 o 96.06533 1.095635   116.2582   157.8   92.32149 2.105050          ?        ? 
1 1 1   16   14    9 o 97.87324 1.106122   133.3405   316.2   95.83993 2.165194          ?        ? 
1 1 1   16   14   10 o 50.18892 0.9586864   71.49975    66.3   25.20046 0.9623086          ?        ? 
1 1 1   16   14   11 o 23.95370 1.318199   28.39152   142.9   5.743780 0.6315150          ?        ? 
1 1 1   16   14   12 o 79.61913 0.8875950   102.2253   274.0   63.42215 1.413391          ?        ? 
1 1 1   16   14   13 o 106.4511 1.016990   131.4612   288.3   113.4021 2.165194          ?        ? 
1 1 1   16   14   14 o 52.42569 1.089868   51.56229   198.8   27.51601 1.142741          ?        ? 
1 1 1   16   14   15 o 29.74037 1.567291   45.77501   221.9   8.871283 0.9322364          ?        ? 
1 1 1   16   14   16 o 53.48324 1.208886   51.59276   244.3   28.68883 1.293102          ?        ? 
1 1 1   16   14   17 o 91.12907 1.171483   99.84774    58.8   83.35999 2.135122          ?        ? 
1 1 1   16   14   18 o 22.82307 2.437598   30.08076    30.2   5.322770 1.112669          ?        ? 
1 1 1   16   14   19 o 42.81938 1.509950   44.14046    36.5   18.55451 1.293102          ?        ? 
1 1 1   16   14   20 o 7.494837 3.452797   6.047260   248.3 -0.7217315 1.202886          ?        ? 
1 1 1   16   14   21 o 11.44455 4.019618   12.51097   127.3   1.473535 1.142741          ?        ? 
1 1 1   16   15    0 o 218.2699 3.466999   200.0310    -0.0   477.2750 15.12629   477.2750 15.12629 
1 1 1   16   15    1 f 146.3629 1.653977   79.65201   302.9   214.3242 4.841615          ?        ? 
1 1 1   16   15    2 o 110.6124 1.386535   145.0405   169.3   122.3936 3.067359          ?        ? 
1 1 1   16   15    3 o 154.5432 1.634533   201.6479   148.3   238.9532 5.052120          ?        ? 
1 1 1   16   15    4 o 108.4897 1.178053   132.5301   187.7   117.7324 2.556132          ?        ? 
1 1 1   16   15    5 o 70.55843 1.086815   104.3431   246.5   49.79947 1.533679          ?        ? 
1 1 1   16   15    6 o 105.2089 1.129039   105.7086    43.9   110.7256 2.375700          ?        ? 
1 1 1   16   15    7 o 123.6547 1.203813   139.4073   343.0   152.9770 2.977142          ?        ? 
1 1 1   16   15    8 f 82.16633 1.043075   76.77300   131.3   67.54204 1.714112          ?        ? 
1 1 1   16   15    9 o 76.81573 1.017859   94.17806   265.6   59.03162 1.563751          ?        ? 
1 1 1   16   15   10 o 51.10729 1.029721   73.77313   356.5   26.13269 1.052525          ?        ? 
1 1 1   16   15   11 o 151.0468 1.204504   188.1439   169.1   228.3378 3.638730          ?        ? 
1 1 1   16   15   12 o 10.19035 2.636532   6.266097   120.2   1.082597 0.5412986          ?        ? 
1 1 1   16   15   13 o 47.12574 0.9252823   53.16141    51.9   22.22332 0.8720922          ?        ? 
1 1 1   16   15   14 o 63.99644 0.8928164   88.16534    70.5   40.98833 1.142741          ?        ? 
1 1 1   16   15   15 o 64.30755 0.9586417   83.30573   141.6   41.40934 1.232958          ?        ? 
1 1 1   16   15   16 o 53.89939 1.171655   78.50483   221.8   29.13991 1.263030          ?        ? 
1 1 1   16   15   17 o 21.76240 2.349127   29.12309   212.6   4.811543 1.022453          ?        ? 
1 1 1   16   15   18 o 45.97721 1.373539   57.66129   158.8   21.29108 1.263030          ?        ? 
1 1 1   16   15   19 o 9.832016 3.867409   11.73213    19.6  0.7217315 1.112669          ?        ? 
1 1 1   16   15   20 o 32.49464 1.943444   28.29785   117.3   10.85604 1.263030          ?        ? 
1 1 1   16   15   21 o 13.96372 4.130060   21.61868   335.6   2.405771 1.232958          ?        ? 
1 1 1   16   16    0 o 55.87921 1.563378   63.11055   180.0   31.30510 1.744184   31.30510 1.744184 
1 1 1   16   16    1 o 201.4923 1.947675   220.4290   169.4   406.2747 7.848830          ?        ? 
1 1 1   16   16    2 o 70.02390 1.245421   126.5901   144.8   49.04767 1.744184          ?        ? 
1 1 1   16   16    3 o 111.5448 1.347985   145.4104   282.0   124.4686 3.007215          ?        ? 
1 1 1   16   16    4 o 165.3133 1.691763   239.0417   257.5   273.4761 5.593419          ?        ? 
1 1 1   16   16    5 o 219.6634 1.827629   221.6800   312.0   482.9286 8.029263          ?        ? 
1 1 1   16   16    6 o 90.67393 1.077867   111.7535   298.6   82.24731 1.954689          ?        ? 
1 1 1   16   16    7 o 80.24253 1.105559   93.41657   223.3   64.41454 1.774257          ?        ? 
1 1 1   16   16    8 o 125.8691 1.290146   198.3607    81.1   158.5403 3.247792          ?        ? 
1 1 1   16   16    9 o 66.51473 1.062464   100.7091   187.9   44.26620 1.413391          ?        ? 
1 1 1   16   16   10 o 72.68746 1.034296   80.54380   166.8   52.86683 1.503607          ?        ? 
1 1 1   16   16   11 f 49.88829 0.9041843   60.65973   201.6   24.89974 0.9021643          ?        ? 
1 1 1   16   16   12 o 6.359404 2.703506   15.92440   238.9   0.000000 0.6014429          ?        ? 
1 1 1   16   16   13 o 45.53229 0.9906864   43.13220   145.7   20.74978 0.9021643          ?        ? 
1 1 1   16   16   14 f 44.45407 1.048539   60.64257    30.1   19.78747 0.9322364          ?        ? 
1 1 1   16   16   15 o 94.76489 1.015470   106.9601   118.0   89.94579 1.924617          ?        ? 
1 1 1   16   16   16 o 46.76206 1.061096   56.87812   170.1   21.92259 0.9923807          ?        ? 
1 1 1   16   16   17 o 50.64779 1.068751   52.10666    46.0   25.74175 1.082597          ?        ? 
1 1 1   16   16   18 o 5.866939 2.848202   14.80014   359.9  -1.714112 1.052525          ?        ? 
1 1 1   16   16   19 o 24.59636 2.322989   19.62491    97.7   6.255006 1.142741          ?        ? 
1 1 1   16   16   20 o 13.77259 4.141856   18.97456   146.5   2.225339 1.232958          ?        ? 
1 1 1   16   16   21 o 23.94387 2.511887   30.46513    85.6   6.164790 1.202886          ?        ? 
1 1 1   16   17    0 o 21.25019 3.708365   23.97915   180.0   4.871688 1.443463   4.871688 1.443463 
1 1 1   16   17    1 o 190.7541 1.789313   213.8815   121.2   364.1136 6.826377          ?        ? 
1 1 1   16   17    2 o 173.4622 1.802989   182.0391   258.3   301.1124 6.255006          ?        ? 
1 1 1   16   17    3 o 184.9844 1.869507   218.2465   151.8   342.4917 6.916593          ?        ? 
1 1 1   16   17    4 o 99.14108 1.364971   144.0783   295.1   98.33591 2.706493          ?        ? 
1 1 1   16   17    5 o 168.3180 1.697295   224.3667    58.0   283.5503 5.713707          ?        ? 
1 1 1   16   17    6 o 12.22116 3.506917   18.78565   259.3   1.533679 0.9021643          ?        ? 
1 1 1   16   17    7 o 150.4808 1.378899   153.1264    32.0   226.6237 4.149956          ?        ? 
1 1 1   16   17    8 o 113.6786 1.243321   159.4711    36.2   129.3102 2.826782          ?        ? 
1 1 1   16   17    9 o 75.88553 1.089778   67.57938   151.6   57.61823 1.653968          ?        ? 
1 1 1   16   17   10 o 116.9860 1.066789   154.3148    56.7   136.9485 2.495988          ?        ? 
1 1 1   16   17   11 o 16.97105 1.949164   24.92768   355.5   2.886926 0.6615872          ?        ? 
1 1 1   16   17   12 o 97.24770 0.9895439   108.1940    35.4   94.63705 1.924617          ?        ? 
1 1 1   16   17   13 o 76.66099 0.9610724   84.11973   271.5   58.82112 1.473535          ?        ? 
1 1 1   16   17   14 o 75.92310 0.9704130   70.29458   330.4   57.70844 1.473535          ?        ? 
1 1 1   16   17   15 o 8.625019 3.230468   11.81821   277.1  0.5713707 0.7518036          ?        ? 
1 1 1   16   17   16 o 74.43394 1.010028   80.50777    22.2   55.54325 1.503607          ?        ? 
1 1 1   16   17   17 o 22.75179 1.784360   28.66739   323.2   5.232553 0.8119479          ?        ? 
1 1 1   16   17   18 o 21.08270 2.068265   13.95344   117.6   4.540894 0.8720922          ?        ? 
1 1 1   16   17   19 o 48.54707 1.455691   57.45501    75.4   23.87728 1.413391          ?        ? 
1 1 1   16   17   20 f 9.647975 3.969965   15.31579    26.7  0.6014429 1.232958          ?        ? 
1 1 1   16   17   21 o 9.610710 3.992041   12.57348   286.3  0.6916593 1.263030          ?        ? 
1 1 1   16   18    0 o 76.34107 1.557422   124.6311   180.0   58.37003 2.375700   58.37003 2.375700 
1 1 1   16   18    1 o 107.0616 1.221856   97.56426   112.2   114.6651 2.616277          ?        ? 
1 1 1   16   18    2 o 171.7067 1.777637   188.6116   124.1   295.0679 6.104645          ?        ? 
1 1 1   16   18    3 o 37.38338 1.528408   45.70533   257.0   13.98355 1.142741          ?        ? 
1 1 1   16   18    4 o 92.71700 1.281156   121.6187   213.2   86.00633 2.375700          ?        ? 
1 1 1   16   18    5 o 98.80603 1.232639   134.7024   250.2   97.67432 2.435844          ?        ? 
1 1 1   16   18    6 o 69.04262 1.197788   105.2407   186.8   47.69442 1.653968          ?        ? 
1 1 1   16   18    7 o 57.73209 1.224095   63.65471   214.6   33.35001 1.413391          ?        ? 
1 1 1   16   18    8 o 127.6532 1.272115   149.7372   124.9   163.0812 3.247792          ?        ? 
1 1 1   16   18    9 o 31.19243 1.590739   28.32211   317.9   9.743376 0.9923807          ?        ? 
1 1 1   16   18   10 o 45.73560 1.052035   43.84778   147.6   20.93021 0.9623086          ?        ? 
1 1 1   16   18   11 o 47.69625 1.008788   80.99039   232.4   22.76461 0.9623086          ?        ? 
1 1 1   16   18   12 o 35.43442 1.188139   49.93246   152.1   12.57016 0.8420200          ?        ? 
1 1 1   16   18   13 o 31.28233 1.345840   54.08757   168.8   9.803518 0.8420200          ?        ? 
1 1 1   16   18   14 o 92.20078 1.043710   82.69601   126.9   85.13425 1.924617          ?        ? 
1 1 1   16   18   15 o 63.24295 1.022329   81.27579   306.4   40.08617 1.293102          ?        ? 
1 1 1   16   18   16 o 10.66888 3.316686   12.41506   267.4   1.172814 0.7818757          ?        ? 
1 1 1   16   18   17 f 21.09577 1.924433   28.80435   236.2   4.510822 0.8119479          ?        ? 
1 1 1   16   18   18 o 19.61481 2.146389   31.08360   345.9   3.939451 0.8420200          ?        ? 
1 1 1   16   18   19 o 36.05801 1.417789   37.66648   242.8   13.17160 1.022453          ?        ? 
1 1 1   16   18   20 o 13.57741 4.153702   10.39366   161.1   2.195267 1.232958          ?        ? 
1 1 1   16   18   21 o 12.46732 4.236907   21.96825   231.1   1.954689 1.263030          ?        ? 
1 1 1   16   19    0 o 99.57617 1.631788   71.41230   180.0   99.26815 3.247792   99.26815 3.247792 
1 1 1   16   19    1 o 64.73461 1.161363   91.71163   233.8   41.92057 1.503607          ?        ? 
1 1 1   16   19    2 o 108.9925 1.241596   109.3032   221.7   118.8451 2.706493          ?        ? 
1 1 1   16   19    3 o 66.78549 1.305811   105.6161   195.3   44.62706 1.744184          ?        ? 
1 1 1   16   19    4 o 104.1627 1.328036   154.5581   187.9   108.5604 2.766637          ?        ? 
1 1 1   16   19    5 o 125.1345 1.453927   131.1935   130.1   156.7059 3.638730          ?        ? 
1 1 1   16   19    6 o 148.5164 1.538875   200.9334   116.5   220.7897 4.570966          ?        ? 
1 1 1   16   19    7 o 82.37390 1.259488   94.57795     1.0   67.90290 2.074978          ?        ? 
1 1 1   16   19    8 o 37.93291 1.506267   52.92388   292.1   14.40456 1.142741          ?        ? 
1 1 1   16   19    9 o 83.12562 0.9586838   112.9184   103.3   69.13586 1.593824          ?        ? 
1 1 1   16   19   10 o 73.48949 1.002548   93.81398   139.8   54.03964 1.473535          ?        ? 
1 1 1   16   19   11 o 120.3162 1.137239   126.9193    77.9   144.8876 2.736565          ?        ? 
1 1 1   16   19   12 o 77.71185 0.9867731   90.20336   289.3   60.44501 1.533679          ?        ? 
1 1 1   16   19   13 o 103.4233 1.090378   110.2384   151.1   107.1170 2.255411          ?        ? 
1 1 1   16   19   14 o 57.57086 1.044700   74.40256   278.9   33.19965 1.202886          ?        ? 
1 1 1   16   19   15 o 53.65852 1.092849   46.22855   130.0   28.86926 1.172814          ?        ? 
1 1 1   16   19   16 o 5.766652 2.684384   15.48743   210.8 -0.6615872 0.7518036          ?        ? 
1 1 1   16   19   17 o 11.41764 3.420619   15.35565   122.0   1.383319 0.8420200          ?        ? 
1 1 1   16   19   18 o 20.56572 2.047145   24.03266   295.4   4.330389 0.8420200          ?        ? 
1 1 1   16   19   19 o 20.57840 2.265085   24.45021   266.9   4.390533 0.9322364          ?        ? 
1 1 1   16   19   20 o 16.87953 3.145875   11.92252   273.2   3.217719 1.022453          ?        ? 
1 1 1   16   20    0 o 6.380216 4.303355   7.032275   180.0 -0.5713707 1.533679 -0.5713707 1.533679 
1 1 1   16   20    1 o 52.84266 1.223540   68.00773   312.5   27.93702 1.293102          ?        ? 
1 1 1   16   20    2 o 38.45255 1.407705   36.36499   227.0   14.79550 1.082597          ?        ? 
1 1 1   16   20    3 o 13.89425 3.469713   12.56760   305.8   2.014834 0.9623086          ?        ? 
1 1 1   16   20    4 o 92.20685 1.288245   99.24903   353.0   85.07410 2.375700          ?        ? 
1 1 1   16   20    5 o 107.3205 1.359012   116.8465   317.7   115.2665 2.916998          ?        ? 
1 1 1   16   20    6 o 135.5221 1.475625   181.5392   213.1   183.8310 3.999595          ?        ? 
1 1 1   16   20    7 o 60.69556 1.288193   53.00307   268.9   36.86845 1.563751          ?        ? 
1 1 1   16   20    8 o 56.03199 1.261235   76.71371    30.7   31.42539 1.413391          ?        ? 
1 1 1   16   20    9 o 40.13406 1.123938   52.98388   229.8   16.11867 0.9021643          ?        ? 
1 1 1   16   20   10 o 62.98225 1.026561   81.43305   345.1   39.69523 1.293102          ?        ? 
1 1 1   16   20   11 o 39.44555 1.219794   56.71440   248.9   15.57737 0.9623086          ?        ? 
1 1 1   16   20   12 o 71.46184 1.052035   50.73603   103.2   51.12265 1.503607          ?        ? 
1 1 1   16   20   13 o 33.90168 1.330560   45.72429   274.0   11.51763 0.9021643          ?        ? 
1 1 1   16   20   14 f 33.89031 1.286640   21.89005   346.0   11.51763 0.8720922          ?        ? 
1 1 1   16   20   15 o 56.77276 1.112356   72.86710   106.5   32.32756 1.263030          ?        ? 
1 1 1   16   20   16 o 72.26124 1.082013   69.82585    39.0   52.41575 1.563751          ?        ? 
1 1 1   16   20   17 o 20.38655 2.065136   27.70966   354.0   4.240172 0.8420200          ?        ? 
1 1 1   16   20   18 o 21.10820 2.279467   20.47466    50.8   4.601038 0.9623086          ?        ? 
1 1 1   16   20   19 o 11.77925 3.683085   12.00974    66.0   1.563751 0.9623086          ?        ? 
1 1 1   16   20   20 o 8.317305 3.471514   2.767074   315.0  0.3909379 0.9623086          ?        ? 
1 1 1   16   21    0 o 72.94861 1.630148   101.4010   180.0   53.31791 2.375700   53.31791 2.375700 
1 1 1   16   21    1 o 41.78699 1.331358   63.56543   169.1   17.47192 1.112669          ?        ? 
1 1 1   16   21    2 o 103.4382 1.264657   115.6943    77.2   107.0568 2.616277          ?        ? 
1 1 1   16   21    3 o 58.50972 1.130730   79.48306   259.2   34.25217 1.323174          ?        ? 
1 1 1   16   21    4 o 114.7587 1.218517   130.5075   148.3   131.7761 2.796710          ?        ? 
1 1 1   16   21    5 o 7.521527 3.414333   30.54292   201.8 -0.6615872 1.112669          ?        ? 
1 1 1   16   21    6 o 53.48239 1.349475   56.71214   111.6   28.62868 1.443463          ?        ? 
1 1 1   16   21    7 o 90.23560 1.266398   117.5242     6.0   81.49551 2.285483          ?        ? 
1 1 1   16   21    8 o 43.29853 1.284881   46.78175    73.4   18.76502 1.112669          ?        ? 
1 1 1   16   21    9 o 12.28265 3.423653   30.57942   177.2   1.563751 0.8720922          ?        ? 
1 1 1   16   21   10 o 49.93869 1.114035   43.56183    13.6   24.95988 1.112669          ?        ? 
1 1 1   16   21   11 o 123.3709 1.218769   155.2790   225.2   152.4056 3.007215          ?        ? 
1 1 1   16   21   12 o 67.81186 1.042141   65.65740   230.3   46.04045 1.413391          ?        ? 
1 1 1   16   21   13 o 40.02475 1.277276   40.53741    76.4   16.05853 1.022453          ?        ? 
1 1 1   16   21   14 o 16.51618 2.549077   29.21005    25.6   2.766637 0.8420200          ?        ? 
1 1 1   16   21   15 o 42.70956 1.196984   41.78229   301.4   18.31394 1.022453          ?        ? 
1 1 1   16   21   16 o 13.35443 3.283746   24.31562   254.9   1.924617 0.8720922          ?        ? 
1 1 1   16   21   17 f 32.67477 1.472556   36.26167   262.0   10.79590 0.9623086          ?        ? 
1 1 1   16   21   18 o 8.310478 3.366414   12.53648   340.1  0.3909379 0.8720922          ?        ? 
1 1 1   16   21   19 o 33.33029 1.624044   28.57967   195.7   11.36727 1.082597          ?        ? 
1 1 1   16   21   20 o 9.935593 3.756577   15.90821   130.7   1.022453 1.022453          ?        ? 
1 1 1   16   22    0 o 74.10165 1.706467   40.80115   180.0   55.03202 2.526060   55.03202 2.526060 
1 1 1   16   22    1 o 58.01088 1.399648   84.25318    21.8   33.68080 1.623896          ?        ? 
1 1 1   16   22    2 o 179.8804 1.655068   183.7080   266.6   323.9371 5.954284          ?        ? 
1 1 1   16   22    3 o 151.4412 1.469441   168.1402   195.7   229.5407 4.450677          ?        ? 
1 1 1   16   22    4 o 48.59934 1.299431   32.21012   244.3   23.63671 1.263030          ?        ? 
1 1 1   16   22    5 o 23.74256 2.469855   30.90812   346.4   5.653563 1.172814          ?        ? 
1 1 1   16   22    6 o 67.53709 1.246752   89.22757   335.7   45.64952 1.684040          ?        ? 
1 1 1   16   22    7 o 59.03114 1.349986   84.70645    47.1   34.88369 1.593824          ?        ? 
1 1 1   16   22    8 o 70.69389 1.084733   93.52235    98.6   50.00998 1.533679          ?        ? 
1 1 1   16   22    9 o 161.7626 1.477928   186.2498   333.5   262.0487 4.781471          ?        ? 
1 1 1   16   22   10 o 54.89042 1.177894   36.02349    13.9   30.16236 1.293102          ?        ? 
1 1 1   16   22   11 o 79.79941 1.092856   109.4131   254.9   63.75294 1.744184          ?        ? 
1 1 1   16   22   12 o 101.9021 1.091900   109.5776     2.9   103.9895 2.225339          ?        ? 
1 1 1   16   22   13 f 28.17405 1.601056   34.80628    45.8   7.969118 0.9021643          ?        ? 
1 1 1   16   22   14 f 33.54295 1.479269   31.97465     3.1   11.30713 0.9923807          ?        ? 
1 1 1   16   22   15 f 16.65581 2.527707   11.20416   198.5   2.826782 0.8420200          ?        ? 
1 1 1   16   22   16 o 23.43114 1.860968   20.22579   164.7   5.563347 0.8720922          ?        ? 
1 1 1   16   22   17 o 7.393484 3.201589   9.993421   202.2      -0.03 0.8720922          ?        ? 
1 1 1   16   22   18 o 32.58433 1.568934   36.90209   153.2   10.79590 1.022453          ?        ? 
1 1 1   16   22   19 o 36.48647 1.483559   42.14024    28.1   13.59261 1.082597          ?        ? 
1 1 1   16   23    0 o 101.5182 1.704362   115.4408    -0.0   103.2076 3.458297   103.2076 3.458297 
1 1 1   16   23    1 o 25.57768 2.233865   16.80068   252.7   6.555727 1.142741          ?        ? 
1 1 1   16   23    2 o 161.0069 1.503543   173.6849    95.6   259.4926 4.841615          ?        ? 
1 1 1   16   23    3 o 150.8334 1.535174   190.6529   313.6   227.7664 4.631110          ?        ? 
1 1 1   16   23    4 o 91.56754 1.182294   102.0854   322.2   83.90128 2.165194          ?        ? 
1 1 1   16   23    5 o 34.08885 1.676122   55.19197   175.0   11.63792 1.142741          ?        ? 
1 1 1   16   23    6 o 71.56474 1.386690   90.83254   357.5   51.27301 1.984761          ?        ? 
1 1 1   16   23    7 o 16.77645 3.685185   2.930237    84.1   2.947070 1.202886          ?        ? 
1 1 1   16   23    8 o 65.66302 1.144942   71.54934   189.7   43.15353 1.503607          ?        ? 
1 1 1   16   23    9 o 108.5575 1.218869   111.0275   304.0   117.9730 2.646349          ?        ? 
1 1 1   16   23   10 o 85.20040 1.182409   84.28476   231.9   72.68437 2.014834          ?        ? 
1 1 1   16   23   11 o 9.748794 3.696520   10.97265    92.6  0.6916593 0.9923807          ?        ? 
1 1 1   16   23   12 o 36.86125 1.346103   40.89873    49.7   13.62268 0.9923807          ?        ? 
1 1 1   16   23   13 o 18.16902 2.317186   33.69063   117.1   3.338008 0.8420200          ?        ? 
1 1 1   16   23   14 o 26.93438 1.674745   19.86024    34.8   7.307531 0.9021643          ?        ? 
1 1 1   16   23   15 o 13.86917 3.385710   31.73009    23.7   2.074978 0.9322364          ?        ? 
1 1 1   16   23   16 o 32.16544 1.542619   36.19568   233.5   10.46511 0.9923807          ?        ? 
1 1 1   16   23   17 o 24.33063 2.039365   25.00749   302.0   6.074574 0.9923807          ?        ? 
1 1 1   16   23   18 o 7.766329 3.335624   6.208715     8.8       0.09 0.9322364          ?        ? 
1 1 1   16   23   19 o 15.30964 3.425547   24.07987   150.8   2.736565 1.022453          ?        ? 
1 1 1   16   24    0 o 129.9353 1.933477   131.6958    -0.0   169.0957 5.022048   169.0957 5.022048 
1 1 1   16   24    1 o 34.74681 1.644383   46.16323    65.6   12.08900 1.142741          ?        ? 
1 1 1   16   24    2 o 30.10920 1.947600   36.33932   154.6   9.081788 1.172814          ?        ? 
1 1 1   16   24    3 o 99.50536 1.239087   92.59937    49.5   99.08772 2.465916          ?        ? 
1 1 1   16   24    4 o 37.32766 1.570971   15.26331   162.8   13.95348 1.172814          ?        ? 
1 1 1   16   24    5 o 95.08389 1.217638   71.38409   154.9   90.48708 2.315555          ?        ? 
1 1 1   16   24    6 o 77.00005 1.132587   71.23148   101.5   59.33234 1.744184          ?        ? 
1 1 1   16   24    7 o 20.55281 2.414222   22.47058   193.1   4.240172 0.9923807          ?        ? 
1 1 1   16   24    8 o 34.47820 1.613584   36.83103   258.1   11.90857 1.112669          ?        ? 
1 1 1   16   24    9 o 22.55570 2.399831   25.47953   339.3   5.112265 1.082597          ?        ? 
1 1 1   16   24   10 o 141.4481 1.403173   148.7604   103.3   200.4609 3.969523          ?        ? 
1 1 1   16   24   11 o 53.62958 1.177550   45.61543    42.3   28.80912 1.263030          ?        ? 
1 1 1   16   24   12 o 56.75796 1.033171   50.86552   338.4   32.26741 1.172814          ?        ? 
1 1 1   16   24   13 o 65.98222 1.002675   75.23065   281.8   43.63469 1.323174          ?        ? 
1 1 1   16   24   14 o 34.39258 1.530163   33.60786   258.9   11.90857 1.052525          ?        ? 
1 1 1   16   24   15 o 34.49984 1.481823   47.92114     5.5   11.99879 1.022453          ?        ? 
1 1 1   16   24   16 o 38.07006 1.421848   37.84485   152.2   14.64513 1.082597          ?        ? 
1 1 1   16   24   17 o 10.08212 3.673669   7.366855    76.9  0.9623086 0.9623086          ?        ? 
1 1 1   16   24   18 o 45.69596 1.381993   47.72227    22.7   21.23093 1.263030          ?        ? 
1 1 1   16   24   19 o 9.430556 3.665290   13.25155   178.2  0.8420200 0.9923807          ?        ? 
1 1 1   16   25    0 o 20.60951 4.695774   30.39413   360.0   4.871688 1.684040   4.871688 1.684040 
1 1 1   16   25    1 o 17.42104 3.401094   12.98770   332.1   3.157575 1.142741          ?        ? 
1 1 1   16   25    2 o 82.74494 1.290183   106.5626   260.7   68.53442 2.135122          ?        ? 
1 1 1   16   25    3 o 98.51128 1.236327   92.03728   191.9   97.13303 2.435844          ?        ? 
1 1 1   16   25    4 o 59.01020 1.274023   56.80454     6.9   34.85361 1.503607          ?        ? 
1 1 1   16   25    5 o 83.04516 1.140672   76.67167   359.7   69.01557 1.894545          ?        ? 
1 1 1   16   25    6 o 125.1207 1.345933   117.4851   262.8   156.7360 3.368080          ?        ? 
1 1 1   16   25    7 o 13.05785 3.579535   26.32525    47.8   1.774257 0.9623086          ?        ? 
1 1 1   16   25    8 o 62.99501 1.145696   73.26459   268.0   39.72530 1.443463          ?        ? 
1 1 1   16   25    9 o 23.40205 2.248788   14.23644   108.2   5.503202 1.052525          ?        ? 
1 1 1   16   25   10 o 35.14252 1.625867   47.08305   184.7   12.38972 1.142741          ?        ? 
1 1 1   16   25   11 o 59.47838 1.213435   68.30000   258.2   35.45506 1.443463          ?        ? 
1 1 1   16   25   12 o 19.79350 2.506835   17.62378   119.9   3.969523 0.9923807          ?        ? 
1 1 1   16   25   13 f 21.09089 2.352629   16.44208    22.9   4.510822 0.9923807          ?        ? 
1 1 1   16   25   14 o 29.03554 1.708907   29.38821   283.3   8.510417 0.9923807          ?        ? 
1 1 1   16   25   15 o 9.635976 3.552510   10.13158   118.1  0.8119479 0.9021643          ?        ? 
1 1 1   16   25   16 o 11.75882 3.684362   10.52278   340.8   1.503607 0.9623086          ?        ? 
1 1 1   16   25   17 o 14.97985 3.300905   13.74765   228.0   2.495988 0.9623086          ?        ? 
1 1 1   16   25   18 o 9.497769 3.753340   12.00628   283.0  0.7518036 1.052525          ?        ? 
1 1 1   16   25   19 o 10.16985 3.728179   7.616498   211.9   1.142741 0.9923807          ?        ? 
1 1 1   16   26    0 o 8.269363 5.156123   27.20412   360.0  0.5112265 1.684040  0.5112265 1.684040 
1 1 1   16   26    1 o 94.14625 1.245736   108.6474    21.9   88.71283 2.345627          ?        ? 
1 1 1   16   26    2 o 47.24218 1.432244   49.03280    90.1   22.34361 1.353247          ?        ? 
1 1 1   16   26    3 o 141.8337 1.420560   144.3841   229.6   201.3932 4.029667          ?        ? 
1 1 1   16   26    4 o 82.68047 1.145703   63.28242    92.3   68.41413 1.894545          ?        ? 
1 1 1   16   26    5 o 100.7092 1.224275   95.68977    99.8   101.5236 2.465916          ?        ? 
1 1 1   16   26    6 o 61.42557 1.248405   53.22943   324.6   37.77061 1.533679          ?        ? 
1 1 1   16   26    7 o 29.18906 1.751432   53.03006   225.4   8.540489 1.022453          ?        ? 
1 1 1   16   26    8 o 61.78706 1.119424   74.89220   166.6   38.22169 1.383319          ?        ? 
1 1 1   16   26    9 o 44.94504 1.304720   36.35371   175.5   20.23855 1.172814          ?        ? 
1 1 1   16   26   10 o 8.364948 3.566853   24.16727   219.1   0.000000 1.052525          ?        ? 
1 1 1   16   26   11 o 13.03785 3.803146   17.73623    21.3   1.774257 1.052525          ?        ? 
1 1 1   16   26   12 o 25.25846 1.964452   23.66388   130.9   6.435439 0.9923807          ?        ? 
1 1 1   16   26   13 f 51.50078 1.255420   47.68857   156.5   26.64392 1.293102          ?        ? 
1 1 1   16   26   14 o 43.21475 1.322166   50.45545   154.3   18.79509 1.142741          ?        ? 
1 1 1   16   26   15 o 25.65047 1.934430   26.30164   116.9   6.706088 0.9923807          ?        ? 
1 1 1   16   26   16 o 7.997188 3.464864   6.506792   278.3   0.000000 1.022453          ?        ? 
1 1 1   16   26   17 o 13.84574 3.563502   15.13407   348.8   2.195267 0.9923807          ?        ? 
1 1 1   16   26   18 o 12.29126 3.719790   17.61423   227.8   1.804329 0.9923807          ?        ? 
1 1 1   16   27    0 o 10.12787 5.521583   13.63797   180.0   1.473535 1.563751   1.473535 1.563751 
1 1 1   16   27    1 o 97.17481 1.253331   126.2170   308.9   94.51675 2.435844          ?        ? 
1 1 1   16   27    2 f 66.70086 1.307468   81.83035    31.5   44.53685 1.744184          ?        ? 
1 1 1   16   27    3 o 220.7208 1.914245   238.9594    53.6   488.3416 8.450273          ?        ? 
1 1 1   16   27    4 o 96.35065 1.201629   108.9611   284.1   92.92293 2.315555          ?        ? 
1 1 1   16   27    5 o 27.14793 2.326199   34.31829   229.2   7.397748 1.263030          ?        ? 
1 1 1   16   27    6 o 56.52439 1.356653   45.97203   152.2   31.99676 1.533679          ?        ? 
1 1 1   16   27    7 o 41.93841 1.434110   42.79309     0.1   17.62228 1.202886          ?        ? 
1 1 1   16   27    8 o 123.7816 1.226873   137.1099   170.0   153.4581 3.037287          ?        ? 
1 1 1   16   27    9 o 50.18467 1.228421   53.91862   186.1   25.23053 1.232958          ?        ? 
1 1 1   16   27   10 o 45.62904 1.252208   47.81977   187.3   20.87007 1.142741          ?        ? 
1 1 1   16   27   11 o 33.97521 1.593216   34.68480   279.7   11.60785 1.082597          ?        ? 
1 1 1   16   27   12 o 51.53984 1.254469   40.48519   108.5   26.67399 1.293102          ?        ? 
1 1 1   16   27   13 o 12.17655 3.726770   10.25540    71.2   1.563751 0.9923807          ?        ? 
1 1 1   16   27   14 o 16.31227 3.427133   18.45640    97.9   2.886926 1.082597          ?        ? 
1 1 1   16   27   15 f 26.11988 2.014797   17.89442   318.7   6.976738 1.052525          ?        ? 
1 1 1   16   27   16 o 11.44094 3.755615   13.90835   291.1   1.413391 0.9923807          ?        ? 
1 1 1   16   27   17 o 12.65914 3.960823   2.199947   224.8   1.864473 1.112669          ?        ? 
1 1 1   16   27   18 o 12.43504 3.970653   2.909739   149.5   1.894545 1.112669          ?        ? 
1 1 1   16   28    0 o 37.35502 2.643005   55.95419   360.0   14.19405 1.954689   14.19405 1.954689 
1 1 1   16   28    1 o 57.84464 1.351682   51.06731   238.1   33.50037 1.563751          ?        ? 
1 1 1   16   28    2 o 155.4036 1.577106   158.5484    14.9   241.9003 4.901759          ?        ? 
1 1 1   16   28    3 o 23.84630 2.648273   49.60958    83.2   5.713707 1.263030          ?        ? 
1 1 1   16   28    4 o 50.16156 1.438814   60.03979   284.2   25.20046 1.443463          ?        ? 
1 1 1   16   28    5 o 140.6030 1.422300   107.9136   328.0   198.0251 3.999595          ?        ? 
1 1 1   16   28    6 o 37.91241 1.507081   28.28120    73.0   14.40456 1.142741          ?        ? 
1 1 1   16   28    7 f 61.24434 1.153895   56.11053    54.6   37.56011 1.413391          ?        ? 
1 1 1   16   28    8 o 41.81652 1.474248   36.78344    30.3   17.53206 1.232958          ?        ? 
1 1 1   16   28    9 o 68.86742 1.091668   89.10561   181.2   47.51399 1.503607          ?        ? 
1 1 1   16   28   10 o 60.84140 1.112110   75.42792   224.7   37.10903 1.353247          ?        ? 
1 1 1   16   28   11 o 45.03568 1.268707   36.68254   123.8   20.35884 1.142741          ?        ? 
1 1 1   16   28   12 o 33.00747 1.594374   37.71001    26.0   10.97633 1.052525          ?        ? 
1 1 1   16   28   13 o 13.03377 3.731209   11.73179   347.8   1.834401 1.022453          ?        ? 
1 1 1   16   28   14 o 46.44038 1.456972   52.58440   328.0   21.80231 1.353247          ?        ? 
1 1 1   16   28   15 o 43.28100 1.528586   36.46774   168.6   19.00560 1.323174          ?        ? 
1 1 1   16   28   16 o 27.08080 2.054351   29.55568    64.0   7.578181 1.112669          ?        ? 
1 1 1   16   28   17 o 9.856650 3.786529   1.219754   323.1  0.9322364 1.052525          ?        ? 
1 1 1   16   29    0 o 100.0606 1.729255   119.7266    -0.0   100.3207 3.458297   100.3207 3.458297 
1 1 1   16   29    1 o 178.2504 1.687073   165.7488    99.0   318.4039 6.014429          ?        ? 
1 1 1   16   29    2 o 11.93996 4.267543   24.70596   126.9   1.232958 1.293102          ?        ? 
1 1 1   16   29    3 o 63.94973 1.363715   75.48795   121.6   40.95826 1.744184          ?        ? 
1 1 1   16   29    4 o 8.331392 3.716161   36.94136    42.0 -0.5112265 1.263030          ?        ? 
1 1 1   16   29    5 o 40.57521 1.704635   19.72258   188.9   16.50961 1.383319          ?        ? 
1 1 1   16   29    6 o 47.41431 1.331908   50.32240    15.0   22.52404 1.263030          ?        ? 
1 1 1   16   29    7 o 31.25092 1.780218   38.69778   141.6   9.803518 1.112669          ?        ? 
1 1 1   16   29    8 o 85.75622 1.104611   76.11366    49.2   73.67676 1.894545          ?        ? 
1 1 1   16   29    9 o 30.64334 1.766448   34.07270   146.8   9.442654 1.082597          ?        ? 
1 1 1   16   29   10 o 62.47923 1.155154   70.76154   321.8   39.15393 1.443463          ?        ? 
1 1 1   16   29   11 o 60.95415 1.134721   67.49128   301.2   37.28946 1.383319          ?        ? 
1 1 1   16   29   12 o 27.26301 1.820013   24.27869   314.1   7.518036 0.9923807          ?        ? 
1 1 1   16   29   13 o 38.05762 1.422313   39.55965   266.1   14.61506 1.082597          ?        ? 
1 1 1   16   29   14 o 7.170139 3.241997   3.520116   356.5 -0.4210100 0.9923807          ?        ? 
1 1 1   16   29   15 o 33.42908 1.619245   35.80971   335.7   11.36727 1.082597          ?        ? 
1 1 1   16   29   16 o 10.55442 3.842383   5.768657    24.3   1.142741 1.052525          ?        ? 
1 1 1   16   29   17 o 9.328794 3.762346   3.586073   200.2  0.7217315 1.082597          ?        ? 
1 1 1   16   30    0 o 20.45520 5.012359   7.951202   360.0   4.901759 1.774257   4.901759 1.774257 
1 1 1   16   30    1 o 119.0035 1.339308   118.5987   265.5   141.8503 3.187647          ?        ? 
1 1 1   16   30    2 o 74.69236 1.268232   87.41801   256.7   55.87405 1.894545          ?        ? 
1 1 1   16   30    3 o 85.48466 1.301601   72.74442   273.2   73.19559 2.225339          ?        ? 
1 1 1   16   30    4 o 10.66237 4.061875   21.04633    10.3  0.8119479 1.202886          ?        ? 
1 1 1   16   30    5 o 7.160951 3.361510   21.12813   354.8  -1.293102 1.232958          ?        ? 
1 1 1   16   30    6 o 151.0048 1.344242   171.3005   356.7   228.5182 4.059740          ?        ? 
1 1 1   16   30    7 o 31.00164 1.697531   41.20619   108.9   9.653158 1.052525          ?        ? 
1 1 1   16   30    8 o 15.86894 3.143849   13.88672     0.5   2.646349 0.9623086          ?        ? 
1 1 1   16   30    9 o 14.71820 3.600338   12.88732   228.1   2.315555 1.052525          ?        ? 
1 1 1   16   30   10 o 35.42170 1.570604   41.43864   247.9   12.63030 1.112669          ?        ? 
1 1 1   16   30   11 o 33.34526 1.668407   32.36237   330.4   11.21691 1.112669          ?        ? 
1 1 1   16   30   12 o 47.57606 1.232567   37.15082   340.0   22.76461 1.172814          ?        ? 
1 1 1   16   30   13 f 9.675423 3.553922   8.067799   171.0  0.8420200 0.9021643          ?        ? 
1 1 1   16   30   14 o 9.499334 3.714570   10.13562   268.9  0.6916593 1.022453          ?        ? 
1 1 1   16   30   15 o 17.16073 3.450873   13.32908   283.4   3.307936 1.142741          ?        ? 
1 1 1   16   30   16 f 6.913005 3.201859   5.583169   312.3 -0.6315150 1.052525          ?        ? 
1 1 1   16   31    0 o 136.9524 2.208072   134.1558   180.0   188.1614 6.044501   188.1614 6.044501 
1 1 1   16   31    1 f 86.59966 1.284843   63.63073   248.6   75.12022 2.225339          ?        ? 
1 1 1   16   31    2 o 78.07333 1.367383   78.34116   332.1   61.07653 2.135122          ?        ? 
1 1 1   16   31    3 o 60.77124 1.410299   79.49608   254.0   37.01881 1.714112          ?        ? 
1 1 1   16   31    4 o 55.93324 1.451638   71.95287     2.3   31.36525 1.623896          ?        ? 
1 1 1   16   31    5 o 105.7875 1.264999   111.2891   314.1   112.1390 2.676421          ?        ? 
1 1 1   16   31    6 o 42.52124 1.379092   55.06359     2.6   18.13350 1.172814          ?        ? 
1 1 1   16   31    7 f 27.15802 1.993145   24.66592   235.2   7.427820 1.082597          ?        ? 
1 1 1   16   31    8 o 30.51809 1.822967   31.71847    69.0   9.382509 1.112669          ?        ? 
1 1 1   16   31    9 o 15.39121 3.318496   24.99613   279.8   2.526060 0.9923807          ?        ? 
1 1 1   16   31   10 o 24.35395 2.160892   31.33080    62.1   6.014429 1.052525          ?        ? 
1 1 1   16   31   11 o 25.52256 2.061950   25.82251   247.0   6.615872 1.052525          ?        ? 
1 1 1   16   31   12 o 5.418458 2.642426   9.592736    22.6  -1.623896 0.9322364          ?        ? 
1 1 1   16   31   13 o 19.23450 2.579690   19.30064   153.5   3.849235 0.9923807          ?        ? 
1 1 1   16   31   14 o 23.72332 2.154953   24.01694   198.0   5.803924 1.022453          ?        ? 
1 1 1   16   31   15 o 9.340900 3.795284   7.290826   253.3  0.6014429 1.112669          ?        ? 
1 1 1   16   31   16 o 20.71899 2.322286   24.18541   167.7   4.570966 0.9623086          ?        ? 
1 1 1   16   32    0 f 97.34074 1.963530   118.0257   180.0   95.08813 3.819162   95.08813 3.819162 
1 1 1   16   32    1 o 30.17734 2.441459   44.82413   109.9   9.172004 1.473535          ?        ? 
1 1 1   16   32    2 o 24.23145 2.730283   27.53368   164.2   5.924213 1.323174          ?        ? 
1 1 1   16   32    3 o 37.94331 1.902131   38.75881    56.5   14.46470 1.443463          ?        ? 
1 1 1   16   32    4 o 63.17152 1.404317   52.73000   243.8   40.02603 1.774257          ?        ? 
1 1 1   16   32    5 o 31.35229 2.062214   23.30956    35.5   9.893736 1.293102          ?        ? 
1 1 1   16   32    6 o 69.09286 1.196917   71.39809   164.1   47.87486 1.653968          ?        ? 
1 1 1   16   32    7 f 65.69054 1.121573   70.71973   270.0   43.27382 1.473535          ?        ? 
1 1 1   16   32    8 o 25.81639 2.038482   40.37643   305.5   6.736160 1.052525          ?        ? 
1 1 1   16   32    9 o 44.62716 1.381399   42.29964   208.0   20.02805 1.232958          ?        ? 
1 1 1   16   32   10 o 40.85598 1.398500   36.13772    11.8   16.81033 1.142741          ?        ? 
1 1 1   16   32   11 o 28.67024 1.940461   28.22559   194.5   8.360056 1.112669          ?        ? 
1 1 1   16   32   12 o 22.05623 2.454176   24.26563   310.6   5.022048 1.082597          ?        ? 
1 1 1   16   32   13 o 17.98657 2.842268   19.38829    99.0   3.398152 1.022453          ?        ? 
1 1 1   16   32   14 o 27.79752 1.947291   19.90100   284.7   7.969118 1.082597          ?        ? 
1 1 1   16   32   15 o 9.943864 3.951768   17.62113   321.6  0.8720922 1.172814          ?        ? 
1 1 1   16   33    0 f 71.37585 1.856595   55.21846    -0.0   51.18279 2.646349   51.18279 2.646349 
1 1 1   16   33    1 o 60.76818 1.459856   59.07608   296.2   37.04888 1.774257          ?        ? 
1 1 1   16   33    2 o 66.18645 1.385783   64.58329   273.0   43.93541 1.834401          ?        ? 
1 1 1   16   33    3 o 31.56491 2.286499   25.34614   217.6   10.04410 1.443463          ?        ? 
1 1 1   16   33    4 o 24.35981 2.715897   12.70003    50.9   6.014429 1.323174          ?        ? 
1 1 1   16   33    5 o 53.01588 1.276265   45.72792   280.0   28.20767 1.353247          ?        ? 
1 1 1   16   33    6 o 60.01939 1.227549   57.17134   141.1   36.14672 1.473535          ?        ? 
1 1 1   16   33    7 o 9.303723 3.790213   5.829044     9.0  0.3909379 1.112669          ?        ? 
1 1 1   16   33    8 o 7.867682 3.411209   22.65611   336.1      -0.09 0.9923807          ?        ? 
1 1 1   16   33    9 o 20.24745 2.747678   17.05171   343.4   4.210100 1.112669          ?        ? 
1 1 1   16   33   10 o 13.00398 3.806321   19.15433   184.8   1.834401 1.052525          ?        ? 
1 1 1   16   33   11 o 26.92446 2.177970   24.73133    63.6   7.427820 1.172814          ?        ? 
1 1 1   16   33   12 o 43.82663 1.440939   34.43335    88.5   19.45668 1.263030          ?        ? 
1 1 1   16   33   13 o 20.17857 2.384481   23.58031    74.4   4.240172 0.9623086          ?        ? 
1 1 1   16   33   14 o 29.22854 1.851952   17.93096   182.5   8.811138 1.082597          ?        ? 
1 1 1   16   33   15 o 26.94108 2.232438   20.34794   127.9   7.698469 1.202886          ?        ? 
1 1 1   16   34    0 o 84.07676 1.861941   68.12106   180.0   71.03040 3.127503   71.03040 3.127503 
1 1 1   16   34    1 o 46.46493 1.682722   45.61573   259.8   21.71209 1.563751          ?        ? 
1 1 1   16   34    2 o 7.838560 3.580497   5.992608   349.7 -0.8119479 1.263030          ?        ? 
1 1 1   16   34    3 o 60.70905 1.411744   60.51067   314.0   37.01881 1.714112          ?        ? 
1 1 1   16   34    4 o 18.75495 3.575757   8.295493   176.6   3.728946 1.293102          ?        ? 
1 1 1   16   34    5 o 14.02417 3.621277   14.62984   167.6   2.105050 1.022453          ?        ? 
1 1 1   16   34    6 o 27.31545 2.036703   31.92428     1.2   7.548109 1.112669          ?        ? 
1 1 1   16   34    7 o 34.87109 1.724761   31.07336   229.2   12.26943 1.202886          ?        ? 
1 1 1   16   34    8 o 12.14246 3.920602   9.759440   125.5   1.533679 1.082597          ?        ? 
1 1 1   16   34    9 o 36.83146 1.632960   27.03484    31.4   13.71290 1.202886          ?        ? 
1 1 1   16   34   10 o 37.85297 1.628614   25.61101   150.5   14.52485 1.232958          ?        ? 
1 1 1   16   34   11 o 24.76176 2.186026   11.81738   349.6   6.315150 1.082597          ?        ? 
1 1 1   16   34   12 o 18.92416 2.939812   26.97727   306.3   3.789090 1.112669          ?        ? 
1 1 1   16   34   13 o 16.49882 3.480413   7.263529   205.6   3.097431 1.112669          ?        ? 
1 1 1   16   34   14 f 13.63746 3.668151   11.72743    43.4   2.225339 1.022453          ?        ? 
1 1 1   16   35    0 o 10.25954 5.801783   4.484675     0.0   1.503607 1.804329   1.503607 1.804329 
1 1 1   16   35    1 f 22.82193 3.096563   24.63080   293.3   5.322770 1.413391          ?        ? 
1 1 1   16   35    2 o 53.07828 1.529718   37.69938    98.6   28.32796 1.623896          ?        ? 
1 1 1   16   35    3 o 63.16271 1.380707   56.83667    57.0   40.08617 1.744184          ?        ? 
1 1 1   16   35    4 o 34.16786 2.112311   24.33414   101.2   11.81835 1.443463          ?        ? 
1 1 1   16   35    5 o 32.35021 1.719725   30.37623    37.8   10.55532 1.112669          ?        ? 
1 1 1   16   35    6 o 44.81132 1.409276   24.30322   125.0   20.20848 1.263030          ?        ? 
1 1 1   16   35    7 f 35.06262 1.672456   31.44911    24.2   12.41980 1.172814          ?        ? 
1 1 1   16   35    8 o 56.07030 1.314007   53.79028     9.4   31.66597 1.473535          ?        ? 
1 1 1   16   35    9 o 35.38977 1.741969   34.03174   102.4   12.72052 1.232958          ?        ? 
1 1 1   16   35   10 o 28.21195 1.971982   26.06591   331.0   8.149551 1.112669          ?        ? 
1 1 1   16   35   11 o 37.04090 1.623726   40.33388   255.7   13.95348 1.202886          ?        ? 
1 1 1   16   35   12 o 23.42211 2.503647   19.82179   230.5   5.773852 1.172814          ?        ? 
1 1 1   16   35   13 o 10.33465 3.875421   5.001034    63.1   1.082597 1.082597          ?        ? 
1 1 1   16   35   14 o 15.87089 3.327730   19.28471   112.7   2.947070 1.022453          ?        ? 
1 1 1   16   36    0 o 46.04217 2.364534   46.06770     0.0   21.53165 2.165194   21.53165 2.165194 
1 1 1   16   36    1 o 66.56247 1.355365   50.33162    48.4   44.53685 1.804329          ?        ? 
1 1 1   16   36    2 o 53.86115 1.507484   35.83653   299.8   29.20005 1.623896          ?        ? 
1 1 1   16   36    3 o 42.38681 1.773674   32.54256   204.0   18.13350 1.503607          ?        ? 
1 1 1   16   36    4 o 36.83485 1.836910   23.40677   144.8   13.71290 1.353247          ?        ? 
1 1 1   16   36    5 o 41.23939 1.494879   49.94571   290.0   17.14112 1.232958          ?        ? 
1 1 1   16   36    6 o 11.82796 3.867748   13.51266     6.9   1.443463 1.052525          ?        ? 
1 1 1   16   36    7 o 11.66688 3.867744   17.02522   338.5   1.413391 1.052525          ?        ? 
1 1 1   16   36    8 o 39.54951 1.596771   43.94304    99.0   15.84802 1.263030          ?        ? 
1 1 1   16   36    9 o 8.366827 3.644510   12.70761   220.2      -0.03 1.142741          ?        ? 
1 1 1   16   36   10 o 26.01843 2.196023   21.86661   129.4   6.976738 1.142741          ?        ? 
1 1 1   16   36   11 o 11.10950 3.959835   6.389968   263.9   1.293102 1.112669          ?        ? 
1 1 1   16   36   12 o 11.84406 4.030103   13.42066    66.5   1.593824 1.142741          ?        ? 
1 1 1   16   36   13 o 11.23733 3.915682   14.83335   145.1   1.473535 1.082597          ?        ? 
1 1 1   16   37    0 o 10.83386 6.016196   16.17820   180.0   1.774257 1.894545   1.774257 1.894545 
1 1 1   16   37    1 o 24.19847 3.106823   12.70977   179.5   6.044501 1.503607          ?        ? 
1 1 1   16   37    2 o 69.65292 1.316815   74.85574   158.2   48.80709 1.834401          ?        ? 
1 1 1   16   37    3 f 57.56199 1.515049   35.70677   332.2   33.41015 1.744184          ?        ? 
1 1 1   16   37    4 o 9.243278 3.923225   12.89388    52.2  0.1503607 1.263030          ?        ? 
1 1 1   16   37    5 o 19.64198 2.985477   17.98086     5.5   3.999595 1.172814          ?        ? 
1 1 1   16   37    6 o 8.932393 3.702203   6.897396   226.7  0.3307936 1.082597          ?        ? 
1 1 1   16   37    7 o 17.30874 3.247103   18.03878   331.1   3.247792 1.082597          ?        ? 
1 1 1   16   37    8 o 29.94040 2.059021   26.66976   317.5   9.202076 1.232958          ?        ? 
1 1 1   16   37    9 o 10.21082 3.981290   9.894395   266.3  0.8420200 1.172814          ?        ? 
1 1 1   16   37   10 o 9.895253 3.873840   9.084607   307.8  0.8119479 1.112669          ?        ? 
1 1 1   16   37   11 o 25.48228 2.478251   19.06586   105.2   6.856449 1.263030          ?        ? 
1 1 1   16   37   12 o 7.972222 3.509209   11.00516    20.5       0.03 1.082597          ?        ? 
1 1 1   16   38    0 o 17.94563 6.298474   29.89502     0.0   4.420605 2.044906   4.420605 2.044906 
1 1 1   16   38    1 o 18.45345 4.171624   25.83512   110.2   3.759018 1.503607          ?        ? 
1 1 1   16   38    2 o 60.86332 1.432870   57.25743   358.6   37.34960 1.744184          ?        ? 
1 1 1   16   38    3 o 7.746449 3.604241   13.64923   277.7  -1.052525 1.353247          ?        ? 
1 1 1   16   38    4 o 12.63370 4.380202   8.549635   270.7   1.653968 1.353247          ?        ? 
1 1 1   16   38    5 o 84.90250 1.168848   78.01808   138.2   72.59415 1.984761          ?        ? 
1 1 1   16   38    6 o 23.08594 2.605235   29.46849   207.3   5.533275 1.202886          ?        ? 
1 1 1   16   38    7 o 13.19899 3.927631   5.754833   275.4   1.954689 1.112669          ?        ? 
1 1 1   16   38    8 o 13.17162 3.992746   16.48497   329.9   1.954689 1.142741          ?        ? 
1 1 1   16   38    9 o 34.17982 1.759643   41.45975    41.8   11.96871 1.202886          ?        ? 
1 1 1   16   38   10 o 17.48904 3.644774   14.79604   293.3   3.518441 1.232958          ?        ? 
1 1 1   16   38   11 o 14.49428 4.014594   13.87949   152.9   2.586205 1.202886          ?        ? 
1 1 1   16   38   12 x        ?      ?   7.434011   151.6          ?        ?          ?        ? 
1 1 1   16   39    0 o 14.15412 6.522791   6.062306   180.0   3.187647 2.014834   3.187647 2.014834 
1 1 1   16   39    1 o 52.61940 1.543058   43.15971   154.5   28.02724 1.623896          ?        ? 
1 1 1   16   39    2 o 19.43743 3.850020   25.42894   284.3   4.180028 1.443463          ?        ? 
1 1 1   16   39    3 o 12.83697 4.385613   20.12501    13.9   1.744184 1.353247          ?        ? 
1 1 1   16   39    4 o 9.799429 4.105062   13.36048    17.0  0.3909379 1.353247          ?        ? 
1 1 1   16   39    5 f 23.46277 2.627477   22.51728   200.2   5.743780 1.232958          ?        ? 
1 1 1   16   39    6 o 10.37299 3.956870   13.83395   312.4  0.9322364 1.142741          ?        ? 
1 1 1   16   39    7 o 28.23921 2.076569   27.48874   269.5   8.209695 1.172814          ?        ? 
1 1 1   16   39    8 o 41.79916 1.582776   35.61790   172.0   17.83278 1.323174          ?        ? 
1 1 1   16   39    9 o 18.35613 3.316076   23.64485     6.3   3.789090 1.172814          ?        ? 
1 1 1   16   39   10 o 54.98160 1.394721   52.17106   123.6   30.91417 1.533679          ?        ? 
1 1 1   16   39   11 f 14.08583 3.916715   8.626592   331.5   2.465916 1.142741          ?        ? 
1 1 1   16   40    0 o 12.13059 6.431572   28.75097   180.0   2.465916 2.074978   2.465916 2.074978 
1 1 1   16   40    1 o 17.84639 3.978386   12.64627   221.5   3.608657 1.383319          ?        ? 
1 1 1   16   40    2 f 29.38793 2.558205   16.44955   224.0   8.991571 1.503607          ?        ? 
1 1 1   16   40    3 o 8.098949 3.750567   2.834484   137.5 -0.9322364 1.443463          ?        ? 
1 1 1   16   40    4 o 23.85336 3.025702   30.62239     0.1   6.014429 1.443463          ?        ? 
1 1 1   16   40    5 o 21.94849 2.877260   25.52653   103.0   5.082192 1.263030          ?        ? 
1 1 1   16   40    6 o 17.44461 3.570884   11.16803    93.8   3.428224 1.202886          ?        ? 
1 1 1   16   40    7 o 20.04572 2.850338   16.35512    94.6   4.300317 1.142741          ?        ? 
1 1 1   16   40    8 o 45.92345 1.538855   39.44294   293.8   21.56173 1.413391          ?        ? 
1 1 1   16   40    9 o 17.85349 3.406692   19.70611   270.5   3.698874 1.172814          ?        ? 
1 1 1   16   40   10 o 5.622648 2.801446   4.775604   211.2  -2.796710 1.263030          ?        ? 
1 1 1   16   41    0 o 44.13326 2.643044   32.79442   180.0   20.11827 2.315555   20.11827 2.315555 
1 1 1   16   41    1 o 53.70574 1.595837   45.70654   261.7   29.32034 1.714112          ?        ? 
1 1 1   16   41    2 o 45.18172 1.830351   39.29389   107.2   20.87007 1.653968          ?        ? 
1 1 1   16   41    3 o 29.70003 2.480696   28.34780   177.5   9.202076 1.473535          ?        ? 
1 1 1   16   41    4 o 21.81417 3.239616   26.46042   339.3   5.142337 1.413391          ?        ? 
1 1 1   16   41    5 o 25.93195 2.551244   16.84289   141.3   7.097026 1.323174          ?        ? 
1 1 1   16   41    6 o 12.14875 4.082782   11.27890   122.4   1.684040 1.172814          ?        ? 
1 1 1   16   41    7 o 21.71953 3.046047   17.55898   163.1   5.172409 1.323174          ?        ? 
1 1 1   16   41    8 o 22.24794 2.703364   22.23580   229.3   5.382914 1.202886          ?        ? 
1 1 1   16   41    9 o 15.62040 3.943641   17.58369   180.4   3.037287 1.232958          ?        ? 
1 1 1   16   42    0 o 10.94249 6.152292   10.58121   180.0   2.044906 2.014834   2.044906 2.014834 
1 1 1   16   42    1 o 14.10443 4.622842   6.612269   318.7   2.375700 1.503607          ?        ? 
1 1 1   16   42    2 o 13.62001 4.529437   16.01406   331.5   2.195267 1.443463          ?        ? 
1 1 1   16   42    3 o 16.32904 4.343221   21.95691   257.6   3.217719 1.443463          ?        ? 
1 1 1   16   42    4 o 15.27402 4.514240   12.20327   140.9   2.856854 1.473535          ?        ? 
1 1 1   16   42    5 o 38.47625 1.836705   28.50262    21.9   15.30672 1.413391          ?        ? 
1 1 1   16   42    6 f 35.42152 1.910204   32.62160    80.5   13.08138 1.353247          ?        ? 
1 1 1   16   42    7 o 17.25448 3.922138   14.76782   131.0   3.638730 1.323174          ?        ? 
1 1 1   16   43    0 o 22.39740 5.342531   12.02520   360.0   6.315150 2.074978   6.315150 2.074978 
1 1 1   16   43    1 o 12.34272 4.456617   4.559319   100.8   1.744184 1.413391          ?        ? 
1 1 1   16   43    2 o 16.87899 4.341171   15.67259   295.8   3.518441 1.473535          ?        ? 
1 1 1   16   43    3 o 7.552389 3.620531   12.46201    96.2  -1.563751 1.563751          ?        ? 
1 1 1   16   43    4 o 15.89170 4.396233   12.30075   316.9   3.217719 1.443463          ?        ? 
1 1 1   16   43    5 o 6.224468 3.029006   5.465769    66.0  -1.714112 1.202886          ?        ? 
1 1 1   16   43    6 o 19.13697 3.423664   23.62774   171.8   4.300317 1.263030          ?        ? 
1 1 1   16   44    0 o 10.54701 6.146146  0.4530728   180.0   2.044906 2.105050   2.044906 2.105050 
1 1 1   16   44    1 o 20.76591 3.979538   16.40318    71.1   5.232553 1.593824          ?        ? 
1 1 1   16   44    2 o 20.22159 4.009071   15.32471    96.3   4.991976 1.563751          ?        ? 
1 1 1   16   44    3 o 9.505877 4.095510   7.171185   252.5  0.4811543 1.413391          ?        ? 
1 1 1   17    0    1 o 48.97498 1.168134   6.514611    90.0   24.02764 1.142741   24.02764 1.142741 
1 1 1   17    0    2 o 42.70793 1.199118   63.78846   270.0   18.28386 1.022453   18.28386 1.022453 
1 1 1   17    0    3 o 8.844579 4.064019   19.27951   270.0   1.142741 0.7818757   1.142741 0.7818757 
1 1 1   17    0    4 o 135.6039 1.575006   207.2933   270.0   183.9814 4.270245   183.9814 4.270245 
1 1 1   17    0    5 o 142.0940 1.460632   83.41996    90.0   201.9946 4.149956   201.9946 4.149956 
1 1 1   17    0    6 o 39.03558 1.119079   23.60257    90.0   15.27665 0.8720922   15.27665 0.8720922 
1 1 1   17    0    7 o 184.4796 1.720099   222.9008   270.0   340.5069 6.345222   340.5069 6.345222 
1 1 1   17    0    8 f 20.76497 1.612184   78.09608   270.0   4.390533 0.6615872   4.390533 0.6615872 
1 1 1   17    0    9 o 48.26892 1.060260   79.41693   270.0   23.33598 1.022453   23.33598 1.022453 
1 1 1   17    0   10 o 120.5451 1.484840   156.7227   270.0   145.4289 3.578585   145.4289 3.578585 
1 1 1   17    0   11 o 81.91975 0.9914761   120.1527   270.0   67.15110 1.623896   67.15110 1.623896 
1 1 1   17    0   12 o 23.41187 1.292761   32.64352   270.0   5.533275 0.6014429   5.533275 0.6014429 
1 1 1   17    0   13 o 44.20127 1.055874   56.06575    90.0   19.57697 0.9322364   19.57697 0.9322364 
1 1 1   17    0   14 o 8.961023 4.066923   9.634987    90.0   1.172814 0.7818757   1.172814 0.7818757 
1 1 1   17    0   15 f 36.50077 1.280456   57.69153    90.0   13.38210 0.9322364   13.38210 0.9322364 
1 1 1   17    0   16 o 47.40941 1.334381   71.71221    90.0   22.55411 1.263030   22.55411 1.263030 
1 1 1   17    0   17 o 17.51858 2.725420   18.81108   270.0   3.247792 0.9021643   3.247792 0.9021643 
1 1 1   17    0   18 o 10.69505 4.719282   8.199954   270.0   1.684040 1.052525   1.684040 1.052525 
1 1 1   17    0   19 o 4.085120 2.924778   3.071677    90.0  -1.232958 0.9923807  -1.232958 0.9923807 
1 1 1   17    0   20 o 47.17838 1.629662   40.30673    90.0   22.49397 1.533679   22.49397 1.533679 
1 1 1   17    0   21 o 13.98184 4.616151   10.76143   270.0   2.616277 1.142741   2.616277 1.142741 
1 1 1   17    0   22 o 8.382624 4.738325   4.006756   270.0   1.142741 1.202886   1.142741 1.202886 
1 1 1   17    1    0 o 398.0031 3.464904   447.9664    -0.0   1585.133 27.57616   1585.133 27.57616 
1 1 1   17    1    1 o 81.72285 0.8831453   97.47251    27.8   66.79024 1.443463          ?        ? 
1 1 1   17    1    2 o 321.2603 2.026587   410.9139    73.1   1032.437 13.02124          ?        ? 
1 1 1   17    1    3 o 141.4596 1.084182   179.1453   327.9   200.1301 3.067359          ?        ? 
1 1 1   17    1    4 o 202.3100 1.382388   246.1516    43.2   409.3721 5.593419          ?        ? 
1 1 1   17    1    5 o 141.1816 1.086317   245.9205    42.8   199.3483 3.067359          ?        ? 
1 1 1   17    1    6 o 38.10995 0.7496347   89.87444   150.7   14.52485 0.5713707          ?        ? 
1 1 1   17    1    7 o 130.4644 0.9681035   188.6611   140.8   170.2384 2.526060          ?        ? 
1 1 1   17    1    8 o 129.2102 1.024048   147.5810    88.4   166.9906 2.646349          ?        ? 
1 1 1   17    1    9 o 58.82485 1.022430   111.3192    70.4   34.61304 1.202886          ?        ? 
1 1 1   17    1   10 o 215.9897 1.830868   282.6554   299.9   467.0204 7.908974          ?        ? 
1 1 1   17    1   11 o 123.6308 1.289180   145.0360   320.9   152.9469 3.187647          ?        ? 
1 1 1   17    1   12 f 54.72170 0.7144110   50.04000    83.3   29.95186 0.7818757          ?        ? 
1 1 1   17    1   13 o 64.01392 0.6811739   76.06493   315.3   40.98833 0.8720922          ?        ? 
1 1 1   17    1   14 o 160.1255 1.248894   173.4999   272.9   256.6657 3.999595          ?        ? 
1 1 1   17    1   15 o 79.32425 0.9098498   93.56738   319.3   62.97107 1.443463          ?        ? 
1 1 1   17    1   16 o 48.06156 0.9698359   61.14624   314.8   23.12548 0.9322364          ?        ? 
1 1 1   17    1   17 o 46.20805 0.8785784   55.56816   152.5   21.38129 0.8119479          ?        ? 
1 1 1   17    1   18 o 24.26732 1.487044   21.18881   155.4   5.924213 0.7217315          ?        ? 
1 1 1   17    1   19 o 13.22260 2.813288   12.44958   124.8   1.864473 0.7217315          ?        ? 
1 1 1   17    1   20 o 6.004267 2.683548   17.25021   216.5 -0.2405772 0.6615872          ?        ? 
1 1 1   17    1   21 o 22.88161 1.774237   32.55237   197.8   5.352841 0.8119479          ?        ? 
1 1 1   17    1   22 o 8.133887 3.228452   17.09973   245.0  0.5112265 0.7818757          ?        ? 
1 1 1   17    2    0 o 111.9399 1.370552   111.1994   180.0   125.3708 3.067359   125.3708 3.067359 
1 1 1   17    2    1 o 279.3457 1.862381   304.0699    55.3   780.5526 10.40496          ?        ? 
1 1 1   17    2    2 o 117.3529 1.063454   112.1056    36.1   137.7304 2.495988          ?        ? 
1 1 1   17    2    3 o 99.96114 0.8874732   44.28588    63.9   99.92973 1.774257          ?        ? 
1 1 1   17    2    4 o 88.14774 0.8870060   78.68457    69.4   77.70642 1.563751          ?        ? 
1 1 1   17    2    5 f 85.69182 0.8071474   161.4059   100.6   73.43618 1.383319          ?        ? 
1 1 1   17    2    6 o 98.26089 0.8263186   145.2141    22.0   96.56166 1.623896          ?        ? 
1 1 1   17    2    7 o 151.8762 1.089024   192.3192   242.6   230.7135 3.307936          ?        ? 
1 1 1   17    2    8 o 46.91302 0.9615288   104.5751   226.3   22.01281 0.9021643          ?        ? 
1 1 1   17    2    9 o 10.48382 3.326558   13.29733    28.0   1.082597 0.7818757          ?        ? 
1 1 1   17    2   10 o 51.63766 1.048263   76.02609   352.4   26.67399 1.082597          ?        ? 
1 1 1   17    2   11 o 33.34615 1.262545   33.83615   225.4   11.12669 0.8420200          ?        ? 
1 1 1   17    2   12 o 114.2865 1.499838   157.3906   322.5   130.7537 3.428224          ?        ? 
1 1 1   17    2   13 o 20.42897 1.692840   32.42933   286.3   4.180028 0.6916593          ?        ? 
1 1 1   17    2   14 o 141.7193 1.092805   187.8641   184.0   201.0022 3.097431          ?        ? 
1 1 1   17    2   15 o 90.01237 0.8352226   99.55878   114.2   81.07450 1.503607          ?        ? 
1 1 1   17    2   16 o 52.02600 0.9248344   56.84538    24.6   27.09500 0.9623086          ?        ? 
1 1 1   17    2   17 o 54.79938 0.8780288   69.86324   143.6   30.07215 0.9623086          ?        ? 
1 1 1   17    2   18 o 39.38115 0.9545224   56.64646    26.6   15.54730 0.7518036          ?        ? 
1 1 1   17    2   19 o 13.13456 2.724316   30.77712   151.6   1.834401 0.6916593          ?        ? 
1 1 1   17    2   20 o 18.06108 2.081281   19.95036   358.0   3.338008 0.7518036          ?        ? 
1 1 1   17    2   21 o 21.68377 1.802906   19.34980   200.1   4.811543 0.7818757          ?        ? 
1 1 1   17    2   22 o 10.12740 3.397079   23.32557   275.6   1.142741 0.8119479          ?        ? 
1 1 1   17    3    0 o 124.5466 1.521662   85.59799   180.0   155.2023 3.789090   155.2023 3.789090 
1 1 1   17    3    1 o 201.3898 1.396171   234.6853   265.4   405.6432 5.623491          ?        ? 
1 1 1   17    3    2 o 129.4508 1.068606   177.2566    63.7   167.5921 2.766637          ?        ? 
1 1 1   17    3    3 o 202.5409 1.388236   207.1228    86.4   410.3044 5.623491          ?        ? 
1 1 1   17    3    4 o 329.0047 2.033726   405.3835    51.6   1082.898 13.38210          ?        ? 
1 1 1   17    3    5 o 98.36861 0.8712699   126.4219    56.2   96.77216 1.714112          ?        ? 
1 1 1   17    3    6 o 199.8147 1.459851   237.2277   112.2   399.3882 5.833996          ?        ? 
1 1 1   17    3    7 f 108.2427 1.111286   110.0350   138.5   117.1912 2.405771          ?        ? 
1 1 1   17    3    8 o 81.75318 0.9747778   109.8823   310.9   66.85038 1.593824          ?        ? 
1 1 1   17    3    9 o 118.1890 1.246761   153.6442    61.2   139.7453 2.947070          ?        ? 
1 1 1   17    3   10 f 146.1925 1.460487   165.5354    98.9   213.8731 4.270245          ?        ? 
1 1 1   17    3   11 o 66.89980 1.101300   93.48248   161.8   44.77742 1.473535          ?        ? 
1 1 1   17    3   12 o 52.09025 1.270079   59.58355    88.5   27.15515 1.323174          ?        ? 
1 1 1   17    3   13 o 134.5648 1.407905   158.7666   124.4   181.2749 3.789090          ?        ? 
1 1 1   17    3   14 o 17.30972 2.345353   34.78222   201.3   3.007215 0.8119479          ?        ? 
1 1 1   17    3   15 o 34.75580 0.9085029   37.18109   191.0   12.08900 0.6315150          ?        ? 
1 1 1   17    3   16 o 17.47633 1.892809   24.12840   205.4   3.067359 0.6615872          ?        ? 
1 1 1   17    3   17 o 37.55624 1.040940   40.58538    49.3   14.13391 0.7818757          ?        ? 
1 1 1   17    3   18 o 11.28887 2.912004   17.28695    58.6   1.353247 0.6615872          ?        ? 
1 1 1   17    3   19 o 15.64585 2.306463   15.44320   197.4   2.495988 0.7217315          ?        ? 
1 1 1   17    3   20 o 24.72101 1.581399   32.78191   251.1   6.194862 0.7818757          ?        ? 
1 1 1   17    3   21 o 7.241693 3.047853   10.54154   342.2  0.1503607 0.7518036          ?        ? 
1 1 1   17    3   22 o 27.89039 1.779073   34.49709    77.2   8.059335 0.9923807          ?        ? 
1 1 1   17    4    0 o 71.19684 1.141083   103.7896     0.0   50.73171 1.623896   50.73171 1.623896 
1 1 1   17    4    1 o 269.1280 1.787827   386.2442   219.0   724.4981 9.623086          ?        ? 
1 1 1   17    4    2 o 121.2225 1.004700   140.0953   281.3   146.9626 2.435844          ?        ? 
1 1 1   17    4    3 o 123.4215 1.059895   204.7142    36.7   152.3455 2.616277          ?        ? 
1 1 1   17    4    4 o 94.07133 0.9430379   143.4905    80.8   88.50232 1.774257          ?        ? 
1 1 1   17    4    5 o 95.40376 0.9456276   85.37820    87.5   91.02839 1.804329          ?        ? 
1 1 1   17    4    6 o 139.8818 1.139408   110.9704   244.7   195.7095 3.187647          ?        ? 
1 1 1   17    4    7 o 76.23588 0.9861546   139.7213    13.4   58.12946 1.503607          ?        ? 
1 1 1   17    4    8 o 47.70681 0.9770475   42.28187   250.9   22.76461 0.9322364          ?        ? 
1 1 1   17    4    9 o 117.4144 1.126927   157.2829   261.9   137.9109 2.646349          ?        ? 
1 1 1   17    4   10 o 95.90527 1.160175   142.7555   147.8   92.02076 2.225339          ?        ? 
1 1 1   17    4   11 f 104.0046 1.171027   167.3464   307.1   108.2296 2.435844          ?        ? 
1 1 1   17    4   12 o 79.61144 1.152096   106.5493     2.8   63.42215 1.834401          ?        ? 
1 1 1   17    4   13 o 105.9534 1.192062   115.4892   194.0   112.3495 2.526060          ?        ? 
1 1 1   17    4   14 o 29.99952 1.904600   41.78311   106.7   9.021644 1.142741          ?        ? 
1 1 1   17    4   15 f 10.17312 2.521990   19.45573   263.1   1.082597 0.5112265          ?        ? 
1 1 1   17    4   16 o 23.93626 1.444794   19.56533   356.7   5.743780 0.6916593          ?        ? 
1 1 1   17    4   17 o 50.34139 0.8661782   58.46663    22.1   25.38089 0.8720922          ?        ? 
1 1 1   17    4   18 f 23.12212 1.560695   32.54536   280.0   5.382914 0.7217315          ?        ? 
1 1 1   17    4   19 o 26.82345 1.401393   28.47342   151.5   7.247387 0.7518036          ?        ? 
1 1 1   17    4   20 o 19.55363 1.999312   25.21186   224.0   3.909379 0.7818757          ?        ? 
1 1 1   17    4   21 o 14.21658 2.741960   16.94174     0.3   2.195267 0.7518036          ?        ? 
1 1 1   17    4   22 f 18.96839 2.140265   14.45141    29.7   3.789090 0.8119479          ?        ? 
1 1 1   17    5    0 o 11.53731 4.038113   35.03633     0.0   1.744184 0.8420200   1.744184 0.8420200 
1 1 1   17    5    1 o 200.0777 1.382781   177.9072   111.6   400.3806 5.533275          ?        ? 
1 1 1   17    5    2 o 132.6508 1.088168   198.1611   275.8   175.9822 2.886926          ?        ? 
1 1 1   17    5    3 o 297.2841 2.053472   391.2284   251.1   884.1512 12.20929          ?        ? 
1 1 1   17    5    4 o 264.7415 1.840168   319.6425   231.8   701.1321 9.743376          ?        ? 
1 1 1   17    5    5 o 38.02997 1.027973   99.30821     7.1   14.46470 0.7818757          ?        ? 
1 1 1   17    5    6 f 42.86224 0.8769999   33.37146   135.7   18.37408 0.7518036          ?        ? 
1 1 1   17    5    7 o 78.27909 0.9796226   140.1488    49.0   61.28703 1.533679          ?        ? 
1 1 1   17    5    8 o 79.59067 0.9823711   102.1082    50.2   63.36201 1.563751          ?        ? 
1 1 1   17    5    9 o 81.23289 1.018041   95.58302     3.9   66.00835 1.653968          ?        ? 
1 1 1   17    5   10 o 97.10150 1.192337   106.2641    72.8   94.33632 2.315555          ?        ? 
1 1 1   17    5   11 o 80.90823 1.133631   116.8051    38.5   65.49713 1.834401          ?        ? 
1 1 1   17    5   12 o 68.13775 1.169560   88.16447    46.2   46.46146 1.593824          ?        ? 
1 1 1   17    5   13 o 76.11594 1.145742   81.18767    26.0   57.97910 1.744184          ?        ? 
1 1 1   17    5   14 o 39.58062 1.709481   50.36734   220.4   15.69766 1.353247          ?        ? 
1 1 1   17    5   15 o 46.52845 1.260319   49.12461    12.1   21.68202 1.172814          ?        ? 
1 1 1   17    5   16 o 57.64831 0.8085549   60.08722   137.8   33.25979 0.9322364          ?        ? 
1 1 1   17    5   17 o 61.67596 0.8776492   77.03102    93.7   38.10141 1.082597          ?        ? 
1 1 1   17    5   18 o 29.71704 1.264937   41.77120    98.7   8.871283 0.7518036          ?        ? 
1 1 1   17    5   19 o 9.044704 2.995942   14.30133   183.0  0.8119479 0.6315150          ?        ? 
1 1 1   17    5   20 f 41.79137 1.115346   43.92029   259.0   17.59221 0.9322364          ?        ? 
1 1 1   17    5   21 o 19.75417 2.055130   21.39823   214.9   4.029667 0.8119479          ?        ? 
1 1 1   17    5   22 f 17.60483 2.391446   21.31784   242.1   3.307936 0.8420200          ?        ? 
1 1 1   17    6    0 o 238.3865 2.700360   246.9782    -0.0   568.6943 12.87088   568.6943 12.87088 
1 1 1   17    6    1 f 251.7150 1.803983   252.1845   241.0   633.8005 9.081788          ?        ? 
1 1 1   17    6    2 o 99.03849 0.9716511   105.1923   137.4   98.09534 1.924617          ?        ? 
1 1 1   17    6    3 o 207.5140 1.528867   186.8793    41.9   430.7234 6.345222          ?        ? 
1 1 1   17    6    4 o 97.73862 1.015341   145.6849    12.1   95.53921 1.984761          ?        ? 
1 1 1   17    6    5 o 195.6131 1.475834   241.0439    78.0   382.7583 5.773852          ?        ? 
1 1 1   17    6    6 o 90.05166 0.9016468   119.7860   110.7   81.10458 1.623896          ?        ? 
1 1 1   17    6    7 o 131.8888 1.242662   123.1606   264.8   173.9974 3.277864          ?        ? 
1 1 1   17    6    8 o 169.1285 1.449123   198.9879   283.1   286.1966 4.901759          ?        ? 
1 1 1   17    6    9 o 148.2944 1.338393   191.2859    28.0   220.0379 3.969523          ?        ? 
1 1 1   17    6   10 o 74.08254 1.156893   103.4139    37.9   54.91174 1.714112          ?        ? 
1 1 1   17    6   11 o 59.19816 1.117581   71.98772    37.4   35.06412 1.323174          ?        ? 
1 1 1   17    6   12 o 94.61376 1.144228   129.8395    86.6   89.58492 2.165194          ?        ? 
1 1 1   17    6   13 o 51.61882 1.369065   78.79333    82.1   26.67399 1.413391          ?        ? 
1 1 1   17    6   14 o 55.64415 1.378114   69.83945   183.6   31.00438 1.533679          ?        ? 
1 1 1   17    6   15 o 32.82627 2.198640   49.59607   310.5   10.82597 1.443463          ?        ? 
1 1 1   17    6   16 o 48.78260 0.8013878   65.21175   185.4   23.81714 0.7818757          ?        ? 
1 1 1   17    6   17 o 45.54524 0.8913642   52.11846    48.6   20.77985 0.8119479          ?        ? 
1 1 1   17    6   18 o 22.72644 1.587868   34.10389   118.3   5.202481 0.7217315          ?        ? 
1 1 1   17    6   19 o 28.18523 1.333684   45.20782   166.1   7.999191 0.7518036          ?        ? 
1 1 1   17    6   20 o 23.45237 1.666944   21.90522   223.1   5.593419 0.7818757          ?        ? 
1 1 1   17    6   21 o 6.624577 2.941034   2.755843     0.3 -0.1804329 0.7818757          ?        ? 
1 1 1   17    6   22 o 8.887825 3.301259   4.730693   307.6  0.7818757 0.7818757          ?        ? 
1 1 1   17    7    0 o 150.6698 1.916757   81.56049   180.0   227.1650 5.773852   227.1650 5.773852 
1 1 1   17    7    1 o 81.72146 0.9751562   45.00193    47.9   66.79024 1.593824          ?        ? 
1 1 1   17    7    2 o 28.33323 1.379786   66.20570   252.8   8.029263 0.7818757          ?        ? 
1 1 1   17    7    3 o 47.45693 1.013876   88.21189   101.6   22.52404 0.9623086          ?        ? 
1 1 1   17    7    4 o 76.17914 0.9868891   89.10416   189.8   58.03924 1.503607          ?        ? 
1 1 1   17    7    5 o 200.3188 1.613805   264.3496   165.6   401.4331 6.465511          ?        ? 
1 1 1   17    7    6 o 60.11908 0.7503146   52.31067   355.3   36.14672 0.9021643          ?        ? 
1 1 1   17    7    7 o 100.2956 1.199341   126.5595    40.1   100.6214 2.405771          ?        ? 
1 1 1   17    7    8 o 15.72296 2.880674   36.26648    46.2   2.556132 0.8720922          ?        ? 
1 1 1   17    7    9 o 98.51753 1.205724   117.1042   278.6   97.10295 2.375700          ?        ? 
1 1 1   17    7   10 o 110.4882 1.211179   153.1857   190.0   122.1531 2.676421          ?        ? 
1 1 1   17    7   11 o 58.32094 1.314862   53.26582    14.3   34.04167 1.533679          ?        ? 
1 1 1   17    7   12 o 42.83577 1.509372   52.64243    21.8   18.37408 1.293102          ?        ? 
1 1 1   17    7   13 o 54.69927 1.319454   64.30756    13.5   29.95186 1.443463          ?        ? 
1 1 1   17    7   14 o 14.33180 4.286820   22.98721   157.8   2.105050 1.323174          ?        ? 
1 1 1   17    7   15 o 42.64894 1.903794   58.40865   149.8   18.25379 1.623896          ?        ? 
1 1 1   17    7   16 f 36.93240 0.8142483   49.18439   103.1   13.65275 0.6014429          ?        ? 
1 1 1   17    7   17 o 16.11265 1.866369   31.47680   260.0   2.616277 0.6014429          ?        ? 
1 1 1   17    7   18 o 23.38397 1.478918   24.91052    97.4   5.503202 0.6916593          ?        ? 
1 1 1   17    7   19 o 26.42469 1.365638   40.13684   172.4   7.036882 0.7217315          ?        ? 
1 1 1   17    7   20 o 17.43241 2.156338   11.15425   174.0   3.127503 0.7518036          ?        ? 
1 1 1   17    7   21 o 22.43817 1.809301   21.14638   355.8   5.172409 0.8119479          ?        ? 
1 1 1   17    7   22 o 12.89592 3.351225   16.61686   327.4   1.954689 0.8720922          ?        ? 
1 1 1   17    8    0 o 91.22079 1.599967   58.13658   180.0   83.29984 2.916998   83.29984 2.916998 
1 1 1   17    8    1 o 303.0040 2.312448   389.1992   132.7   918.6138 14.01362          ?        ? 
1 1 1   17    8    2 o 77.41248 1.048859   109.1191   245.4   59.93378 1.623896          ?        ? 
1 1 1   17    8    3 o 233.0128 1.884245   268.1740   217.1   543.1631 8.781067          ?        ? 
1 1 1   17    8    4 o 131.8502 1.197410   198.7931   176.5   173.8772 3.157575          ?        ? 
1 1 1   17    8    5 o 156.9839 1.235575   164.9101   208.9   246.5014 3.879307          ?        ? 
1 1 1   17    8    6 o 176.1114 1.340438   245.5371   145.1   310.2543 4.721327          ?        ? 
1 1 1   17    8    7 o 321.2773 2.639572   422.1707   167.9   1033.820 16.96069          ?        ? 
1 1 1   17    8    8 o 173.5629 1.611352   222.3491   175.4   301.4432 5.593419          ?        ? 
1 1 1   17    8    9 o 201.9575 1.853846   268.8346   357.8   408.3196 7.487964          ?        ? 
1 1 1   17    8   10 o 101.3649 1.260857   117.5585    26.5   102.8167 2.556132          ?        ? 
1 1 1   17    8   11 o 54.09922 1.278502   58.54924   264.0   29.29027 1.383319          ?        ? 
1 1 1   17    8   12 o 33.72984 1.738540   63.59966   145.8   11.39734 1.172814          ?        ? 
1 1 1   17    8   13 o 33.81100 1.867780   52.78236   242.7   11.45749 1.263030          ?        ? 
1 1 1   17    8   14 o 60.33882 1.569922   71.30789    69.6   36.47751 1.894545          ?        ? 
1 1 1   17    8   15 f 80.60760 1.399006   90.28455   306.4   65.10619 2.255411          ?        ? 
1 1 1   17    8   16 o 59.63149 1.588544   52.49065    44.1   35.69564 1.894545          ?        ? 
1 1 1   17    8   17 o 57.67572 0.8603106   62.98418   275.9   33.31994 0.9923807          ?        ? 
1 1 1   17    8   18 o 55.15708 0.8723347   62.17881    40.5   30.49315 0.9623086          ?        ? 
1 1 1   17    8   19 o 29.58385 1.219807   33.82876   354.0   8.811138 0.7217315          ?        ? 
1 1 1   17    8   20 o 15.41885 2.437937   16.93059   258.9   2.465916 0.7518036          ?        ? 
1 1 1   17    8   21 o 21.98040 2.599456   19.49792   351.3   5.112265 1.142741          ?        ? 
1 1 1   17    8   22 o 19.49287 2.854042   19.08553    30.2   4.180028 1.112669          ?        ? 
1 1 1   17    9    0 o 24.33295 2.261004   23.10876   180.0   6.074574 1.082597   6.074574 1.082597 
1 1 1   17    9    1 o 48.48998 1.209336   86.13440   192.2   23.51642 1.172814          ?        ? 
1 1 1   17    9    2 o 116.3334 1.163248   143.8295    79.3   135.3547 2.706493          ?        ? 
1 1 1   17    9    3 o 100.3475 1.123801   185.3477   141.2   100.7116 2.255411          ?        ? 
1 1 1   17    9    4 o 65.08854 1.016442   68.81081   252.6   42.37165 1.323174          ?        ? 
1 1 1   17    9    5 o 81.12872 0.8896129   116.9261    48.3   65.82793 1.443463          ?        ? 
1 1 1   17    9    6 o 125.5287 1.066059   143.0514    90.1   157.6081 2.676421          ?        ? 
1 1 1   17    9    7 o 131.5208 1.429059   181.9150   199.3   173.0652 3.759018          ?        ? 
1 1 1   17    9    8 o 194.2064 1.765248   221.7719   286.6   377.4956 6.856449          ?        ? 
1 1 1   17    9    9 o 94.35716 1.179210   97.22885   337.0   89.07370 2.225339          ?        ? 
1 1 1   17    9   10 o 124.4150 1.341482   174.2977   118.4   154.9016 3.338008          ?        ? 
1 1 1   17    9   11 o 91.03539 1.288305   100.2905   143.2   82.93897 2.345627          ?        ? 
1 1 1   17    9   12 o 33.90598 1.818202   28.48884   218.6   11.51763 1.232958          ?        ? 
1 1 1   17    9   13 o 46.01160 1.470550   45.57214    35.3   21.20086 1.353247          ?        ? 
1 1 1   17    9   14 o 38.58038 1.597908   61.88246   170.3   14.91578 1.232958          ?        ? 
1 1 1   17    9   15 o 40.44527 1.821641   25.91006   112.7   16.41939 1.473535          ?        ? 
1 1 1   17    9   16 f 24.53832 3.002519   30.00079    22.8   6.104645 1.473535          ?        ? 
1 1 1   17    9   17 o 21.33628 1.338966   35.80281   181.0   4.570966 0.5713707          ?        ? 
1 1 1   17    9   18 o 18.27382 1.645640   18.78300   353.5   3.368080 0.6014429          ?        ? 
1 1 1   17    9   19 o 22.61008 2.194553   30.86179    56.4   5.232553 0.9923807          ?        ? 
1 1 1   17    9   20 o 15.10649 3.624214   14.36039    36.5   2.556132 1.082597          ?        ? 
1 1 1   17    9   21 o 30.97037 1.893445   31.58123   253.6   9.893736 1.172814          ?        ? 
1 1 1   17    9   22 o 11.37249 3.969032   9.625548   267.0   1.533679 1.112669          ?        ? 
1 1 1   17   10    0 f 343.7764 3.604897   319.4110     0.0   1183.068 24.77945   1183.068 24.77945 
1 1 1   17   10    1 o 288.4760 2.189142   268.2381    37.4   832.6376 12.63030          ?        ? 
1 1 1   17   10    2 o 225.2910 1.835369   306.2267    33.3   507.7682 8.269840          ?        ? 
1 1 1   17   10    3 o 196.1828 1.594178   192.1610   266.3   385.0137 6.255006          ?        ? 
1 1 1   17   10    4 o 187.1657 1.438008   245.5983   348.7   350.4307 5.382914          ?        ? 
1 1 1   17   10    5 o 100.7060 0.9406319   143.9921   314.5   101.4333 1.894545          ?        ? 
1 1 1   17   10    6 o 89.09426 0.8775826   115.3736   221.1   79.39046 1.563751          ?        ? 
1 1 1   17   10    7 o 68.44144 0.9227086   106.0577   228.8   46.85240 1.263030          ?        ? 
1 1 1   17   10    8 o 101.9774 1.297518   92.14166   348.8   104.0496 2.646349          ?        ? 
1 1 1   17   10    9 o 53.40447 1.295134   68.68163    59.7   28.53847 1.383319          ?        ? 
1 1 1   17   10   10 o 36.97565 1.382603   51.48072   193.6   13.68283 1.022453          ?        ? 
1 1 1   17   10   11 o 93.86434 1.233458   114.9982   203.2   88.17153 2.315555          ?        ? 
1 1 1   17   10   12 o 8.995955 3.897058   21.99249   269.3 -0.1804329 1.293102          ?        ? 
1 1 1   17   10   13 o 105.4281 1.411931   112.9358    34.6   111.2970 2.977142          ?        ? 
1 1 1   17   10   14 o 39.41222 1.793087   53.25285   163.5   15.57737 1.413391          ?        ? 
1 1 1   17   10   15 o 49.67647 1.543668   43.82267   189.4   24.74938 1.533679          ?        ? 
1 1 1   17   10   16 o 60.84573 1.433284   56.91119    55.8   37.13910 1.744184          ?        ? 
1 1 1   17   10   17 o 27.72948 1.464052   36.50595    94.0   7.728541 0.8119479          ?        ? 
1 1 1   17   10   18 o 23.33392 2.190916   20.26927    75.1   5.533275 1.022453          ?        ? 
1 1 1   17   10   19 o 8.883059 3.561809   9.855090    59.9  0.4811543 0.9623086          ?        ? 
1 1 1   17   10   20 o 38.02652 1.542100   38.22986    36.0   14.67521 1.172814          ?        ? 
1 1 1   17   10   21 o 7.656275 3.427065   6.100114   125.9 -0.2405772 1.082597          ?        ? 
1 1 1   17   10   22 o 18.76356 3.125244   22.12183    19.3   3.969523 1.172814          ?        ? 
1 1 1   17   11    0 o 117.2767 1.847253   160.9330     0.0   137.6703 4.330389   137.6703 4.330389 
1 1 1   17   11    1 o 181.6403 1.597642   239.3933   180.9   330.0418 5.803924          ?        ? 
1 1 1   17   11    2 o 346.5679 2.607477   432.6458   220.1   1202.254 18.07336          ?        ? 
1 1 1   17   11    3 o 106.5494 1.157170   153.8979    24.6   113.5524 2.465916          ?        ? 
1 1 1   17   11    4 f 154.5971 1.283828   128.9196    85.5   239.0735 3.969523          ?        ? 
1 1 1   17   11    5 o 107.0575 1.011229   137.6606   112.2   114.6350 2.165194          ?        ? 
1 1 1   17   11    6 o 184.8828 1.415100   213.2903   131.4   341.9804 5.232553          ?        ? 
1 1 1   17   11    7 o 150.4532 1.179275   148.0003   219.9   226.4433 3.548513          ?        ? 
1 1 1   17   11    8 o 92.24767 1.173577   90.16912   260.3   85.13425 2.165194          ?        ? 
1 1 1   17   11    9 o 111.0814 1.272392   118.6364    85.0   123.4762 2.826782          ?        ? 
1 1 1   17   11   10 f 6.462586 3.019426   5.421247   204.3 -0.9322364 0.9623086          ?        ? 
1 1 1   17   11   11 o 23.99970 2.067485   60.54364   225.0   5.773852 0.9923807          ?        ? 
1 1 1   17   11   12 o 96.08804 1.470933   123.6082   274.6   92.44177 2.826782          ?        ? 
1 1 1   17   11   13 o 69.01436 1.416147   62.40757   197.6   47.69442 1.954689          ?        ? 
1 1 1   17   11   14 o 62.03484 1.381572   66.76844    20.4   38.55249 1.714112          ?        ? 
1 1 1   17   11   15 o 57.03794 1.555330   60.13890   246.2   32.62828 1.774257          ?        ? 
1 1 1   17   11   16 o 110.7713 1.113066   124.1655   239.8   122.9650 2.465916          ?        ? 
1 1 1   17   11   17 o 50.24025 1.107349   57.76588   299.0   25.32075 1.112669          ?        ? 
1 1 1   17   11   18 o 30.59299 1.572760   31.29322   232.3   9.442654 0.9623086          ?        ? 
1 1 1   17   11   19 o 12.31910 3.718105   14.88355    61.8   1.653968 0.9923807          ?        ? 
1 1 1   17   11   20 o 28.07051 1.874788   21.09120   250.1   8.059335 1.052525          ?        ? 
1 1 1   17   11   21 o 12.35571 3.973211   18.13652    21.7   1.774257 1.112669          ?        ? 
1 1 1   17   12    0 o 20.20707 2.930538   36.66167   180.0   4.240172 1.142741   4.240172 1.142741 
1 1 1   17   12    1 o 184.9946 1.633697   171.5831   146.3   342.3714 6.044501          ?        ? 
1 1 1   17   12    2 o 220.3721 1.821751   281.8140   196.8   485.9057 8.029263          ?        ? 
1 1 1   17   12    3 o 54.99810 0.9295349   71.72231   291.6   30.25258 1.022453          ?        ? 
1 1 1   17   12    4 o 143.6511 1.245582   170.1408   260.4   206.4152 3.578585          ?        ? 
1 1 1   17   12    5 o 103.8921 1.013094   111.2755    49.2   107.9590 2.105050          ?        ? 
1 1 1   17   12    6 o 196.5685 1.483960   253.9961   123.8   386.6075 5.833996          ?        ? 
1 1 1   17   12    7 o 110.6689 1.018990   148.2718   125.3   122.5139 2.255411          ?        ? 
1 1 1   17   12    8 o 38.73374 0.7763812   69.83897   152.1   15.00600 0.6014429          ?        ? 
1 1 1   17   12    9 o 47.28450 1.303766   72.76744   149.1   22.37368 1.232958          ?        ? 
1 1 1   17   12   10 o 80.06123 1.220747   118.8274   105.5   64.14388 1.954689          ?        ? 
1 1 1   17   12   11 o 111.8865 1.437939   121.1676    83.3   125.3407 3.217719          ?        ? 
1 1 1   17   12   12 o 103.0317 1.357208   145.5482   193.9   106.2750 2.796710          ?        ? 
1 1 1   17   12   13 o 40.55236 1.705596   27.88218   280.5   16.47953 1.383319          ?        ? 
1 1 1   17   12   14 o 51.29289 1.582964   60.68635   258.3   26.37327 1.623896          ?        ? 
1 1 1   17   12   15 o 56.09056 1.474373   79.04403   150.8   31.54568 1.653968          ?        ? 
1 1 1   17   12   16 o 26.30966 1.314459   30.66410   214.4   6.946666 0.6916593          ?        ? 
1 1 1   17   12   17 o 33.13572 1.361317   22.75088    43.1   11.03648 0.9021643          ?        ? 
1 1 1   17   12   18 o 39.48383 1.370937   39.03085   343.4   15.69766 1.082597          ?        ? 
1 1 1   17   12   19 o 18.66519 2.900044   23.32491   180.5   3.638730 1.082597          ?        ? 
1 1 1   17   12   20 o 32.50311 1.665375   37.47498   182.8   10.76583 1.082597          ?        ? 
1 1 1   17   12   21 o 12.45670 3.969953   17.07567    14.9   1.834401 1.112669          ?        ? 
1 1 1   17   13    0 o 48.62812 1.580614   12.02310   180.0   23.72692 1.533679   23.72692 1.533679 
1 1 1   17   13    1 o 69.70383 1.100140   68.70229    55.1   48.59659 1.533679          ?        ? 
1 1 1   17   13    2 o 130.2607 1.258193   76.55811    91.8   169.7272 3.277864          ?        ? 
1 1 1   17   13    3 o 96.87037 0.9778765   132.3227     9.2   93.85516 1.894545          ?        ? 
1 1 1   17   13    4 o 14.70656 2.351533   46.49938    16.6   2.165194 0.6916593          ?        ? 
1 1 1   17   13    5 o 18.01033 2.254118   17.56980   204.8   3.247792 0.8119479          ?        ? 
1 1 1   17   13    6 o 76.76221 1.057744   103.5855   333.1   58.94140 1.623896          ?        ? 
1 1 1   17   13    7 f 96.42299 1.138352   136.4756   338.9   93.01314 2.195267          ?        ? 
1 1 1   17   13    8 o 46.32690 1.071063   68.37740   231.2   21.47151 0.9923807          ?        ? 
1 1 1   17   13    9 o 53.66636 0.8405306   66.73659   245.6   28.80912 0.9021643          ?        ? 
1 1 1   17   13   10 o 125.6552 1.352174   174.0546   342.2   158.0291 3.398152          ?        ? 
1 1 1   17   13   11 o 45.95459 1.374215   68.10616   119.4   21.14072 1.263030          ?        ? 
1 1 1   17   13   12 o 73.19701 1.417392   100.4248    30.9   53.64870 2.074978          ?        ? 
1 1 1   17   13   13 f 70.82618 1.486068   89.25558   322.7   50.25056 2.105050          ?        ? 
1 1 1   17   13   14 o 45.64936 1.712786   54.01645   336.0   20.90014 1.563751          ?        ? 
1 1 1   17   13   15 o 59.90559 0.9788851   66.63353     9.8   35.93621 1.172814          ?        ? 
1 1 1   17   13   16 o 70.90527 1.060293   77.06445     0.6   50.40092 1.503607          ?        ? 
1 1 1   17   13   17 o 19.71865 2.135086   23.11987    10.1   3.939451 0.8420200          ?        ? 
1 1 1   17   13   18 o 18.92257 2.542753   27.62957   161.9   3.668802 0.9623086          ?        ? 
1 1 1   17   13   19 o 13.93534 3.632050   10.79856   101.2   2.165194 1.022453          ?        ? 
1 1 1   17   13   20 o 20.09978 2.767865   26.29541   104.2   4.270245 1.112669          ?        ? 
1 1 1   17   13   21 o 6.958617 3.214894   10.13842    62.6 -0.5713707 1.052525          ?        ? 
1 1 1   17   14    0 o 173.2484 2.170491   242.4896   180.0   300.4207 7.518036   300.4207 7.518036 
1 1 1   17   14    1 o 91.79741 1.261231   75.68020   204.2   84.29222 2.315555          ?        ? 
1 1 1   17   14    2 o 156.0895 1.454580   172.5508   339.8   243.7347 4.540894          ?        ? 
1 1 1   17   14    3 o 89.69621 1.089616   59.25811    38.3   80.47306 1.954689          ?        ? 
1 1 1   17   14    4 o 181.0043 1.561720   234.8487   102.7   327.8164 5.653563          ?        ? 
1 1 1   17   14    5 o 182.5520 1.606136   197.3772   279.9   333.4700 5.864068          ?        ? 
1 1 1   17   14    6 o 185.4473 1.605384   205.0376   292.6   344.1757 5.954284          ?        ? 
1 1 1   17   14    7 o 34.93171 1.334370   41.24266   301.3   12.20929 0.9322364          ?        ? 
1 1 1   17   14    8 o 100.3569 1.153660   113.4715    21.1   100.7718 2.315555          ?        ? 
1 1 1   17   14    9 o 53.23915 1.016730   96.32469   192.2   28.35803 1.082597          ?        ? 
1 1 1   17   14   10 o 14.38909 1.985430   14.95320   239.1   2.074978 0.5713707          ?        ? 
1 1 1   17   14   11 o 77.09077 1.267784   89.37609   349.0   59.48270 1.954689          ?        ? 
1 1 1   17   14   12 o 76.85567 1.467303   117.0681   353.8   59.15191 2.255411          ?        ? 
1 1 1   17   14   13 o 30.94531 2.380870   39.20154   280.6   9.623086 1.473535          ?        ? 
1 1 1   17   14   14 o 33.46902 1.078208   42.66823   316.5   11.21691 0.7217315          ?        ? 
1 1 1   17   14   15 o 67.37621 1.026563   58.90808    55.9   45.46908 1.383319          ?        ? 
1 1 1   17   14   16 o 21.28633 1.977842   30.30379   139.5   4.570966 0.8420200          ?        ? 
1 1 1   17   14   17 o 41.96169 1.182484   46.60672    16.1   17.68242 0.9923807          ?        ? 
1 1 1   17   14   18 o 40.24245 1.382457   55.05542   240.2   16.32917 1.112669          ?        ? 
1 1 1   17   14   19 o 7.290900 3.271893   6.935194   350.9 -0.3307936 0.9923807          ?        ? 
1 1 1   17   14   20 o 26.62030 2.202856   29.89158   233.8   7.367675 1.172814          ?        ? 
1 1 1   17   14   21 o 20.30134 2.592255   28.07340   199.9   4.450677 1.052525          ?        ? 
1 1 1   17   15    0 o 95.16038 2.452730   126.6248   180.0   90.78780 4.661182   90.78780 4.661182 
1 1 1   17   15    1 o 132.1265 1.570448   144.9470   137.8   174.6590 4.149956          ?        ? 
1 1 1   17   15    2 o 178.7537 1.572972   226.0136   332.6   319.6970 5.623491          ?        ? 
1 1 1   17   15    3 o 52.67620 1.141773   63.23203   122.7   27.75659 1.202886          ?        ? 
1 1 1   17   15    4 o 96.83121 1.164610   106.0522   248.5   93.79502 2.255411          ?        ? 
1 1 1   17   15    5 o 52.15908 1.124266   50.55752    92.4   27.21529 1.172814          ?        ? 
1 1 1   17   15    6 o 109.0033 1.227679   136.9941   171.8   118.8752 2.676421          ?        ? 
1 1 1   17   15    7 o 170.3381 1.500623   216.9571    28.6   290.4067 5.112265          ?        ? 
1 1 1   17   15    8 o 106.2101 1.104239   126.7649   318.8   112.8608 2.345627          ?        ? 
1 1 1   17   15    9 o 73.90007 1.058018   79.91961   123.7   54.64109 1.563751          ?        ? 
1 1 1   17   15   10 o 24.93154 1.568046   34.34895   232.4   6.224934 0.7818757          ?        ? 
1 1 1   17   15   11 o 53.26583 0.9597644   76.49912   303.7   28.38811 1.022453          ?        ? 
1 1 1   17   15   12 o 43.09658 0.9420096   71.67661    74.8   18.58459 0.8119479          ?        ? 
1 1 1   17   15   13 o 14.26372 2.319125   17.67693    95.7   2.044906 0.6615872          ?        ? 
1 1 1   17   15   14 o 34.82243 1.252199   31.13042   288.1   12.14915 0.8720922          ?        ? 
1 1 1   17   15   15 o 73.97609 1.056930   86.03817   312.6   54.82152 1.563751          ?        ? 
1 1 1   17   15   16 o 20.56907 1.973711   25.03664   309.4   4.270245 0.8119479          ?        ? 
1 1 1   17   15   17 o 41.65355 1.263428   43.08740   201.6   17.44184 1.052525          ?        ? 
1 1 1   17   15   18 o 42.83118 1.404217   49.60227   138.9   18.52444 1.202886          ?        ? 
1 1 1   17   15   19 o 18.86077 2.790249   23.47195    53.4   3.728946 1.052525          ?        ? 
1 1 1   17   15   20 o 13.52071 3.899461   13.18190   199.8   2.135122 1.112669          ?        ? 
1 1 1   17   15   21 o 17.46069 3.481798   18.66764   348.3   3.578585 1.172814          ?        ? 
1 1 1   17   16    0 f 23.75103 5.540223   68.82404     0.0   6.495584 2.285483   6.495584 2.285483 
1 1 1   17   16    1 o 134.2325 1.501002   175.5913   330.5   180.2825 4.029667          ?        ? 
1 1 1   17   16    2 o 93.62267 1.316944   123.4666   102.3   87.69038 2.465916          ?        ? 
1 1 1   17   16    3 o 116.5077 1.380905   145.8306   329.8   135.8058 3.217719          ?        ? 
1 1 1   17   16    4 o 91.51539 1.150107   92.11885    70.3   83.78100 2.105050          ?        ? 
1 1 1   17   16    5 o 77.34209 1.147019   110.8914    56.2   59.84357 1.774257          ?        ? 
1 1 1   17   16    6 o 132.5732 1.326981   141.3263   298.1   175.8619 3.518441          ?        ? 
1 1 1   17   16    7 o 91.73781 1.114538   82.46064   249.2   84.20200 2.044906          ?        ? 
1 1 1   17   16    8 o 90.38016 1.147917   86.01716   108.2   81.73608 2.074978          ?        ? 
1 1 1   17   16    9 o 67.94340 1.084384   103.8420    33.9   46.19081 1.473535          ?        ? 
1 1 1   17   16   10 o 201.3217 1.762609   251.4980   194.0   406.0040 7.097026          ?        ? 
1 1 1   17   16   11 o 44.46707 1.048232   41.45440   148.1   19.78747 0.9322364          ?        ? 
1 1 1   17   16   12 o 40.68678 1.108670   35.58256   265.9   16.56975 0.9021643          ?        ? 
1 1 1   17   16   13 o 66.32529 0.9068078   70.00362   132.3   44.02562 1.202886          ?        ? 
1 1 1   17   16   14 f 74.49075 0.8881469   76.97680   155.9   55.54325 1.323174          ?        ? 
1 1 1   17   16   15 o 86.93963 0.9512164   101.6513   274.3   75.72166 1.653968          ?        ? 
1 1 1   17   16   16 o 19.80367 2.125919   26.89585   103.7   3.969523 0.8420200          ?        ? 
1 1 1   17   16   17 o 53.79789 1.145917   61.45214   124.7   29.07976 1.232958          ?        ? 
1 1 1   17   16   18 o 22.25978 2.229089   25.29480    54.5   5.082192 0.9923807          ?        ? 
1 1 1   17   16   19 o 46.92384 1.377874   58.08531   224.7   22.28346 1.293102          ?        ? 
1 1 1   17   16   20 o 16.05925 3.641126   16.90633   132.9   2.977142 1.142741          ?        ? 
1 1 1   17   16   21 o 9.273727 3.876667   13.17629   331.6  0.6014429 1.202886          ?        ? 
1 1 1   17   17    0 o 151.7034 2.151764   228.6246    -0.0   230.4128 6.525656   230.4128 6.525656 
1 1 1   17   17    1 o 160.7691 1.674113   161.3348   331.4   258.6505 5.382914          ?        ? 
1 1 1   17   17    2 o 65.40163 1.310451   91.79242   217.8   42.79266 1.714112          ?        ? 
1 1 1   17   17    3 o 43.34077 1.422400   17.17669   213.7   18.79509 1.232958          ?        ? 
1 1 1   17   17    4 o 204.2888 2.001976   281.9005    92.7   417.8825 8.179624          ?        ? 
1 1 1   17   17    5 o 80.07436 1.089103   101.7132   111.5   64.14388 1.744184          ?        ? 
1 1 1   17   17    6 o 126.5837 1.270985   160.4068    80.2   160.3447 3.217719          ?        ? 
1 1 1   17   17    7 o 109.9053 1.176561   141.9439   110.4   120.8599 2.586205          ?        ? 
1 1 1   17   17    8 o 114.9769 1.203127   161.1829   335.7   132.2874 2.766637          ?        ? 
1 1 1   17   17    9 o 87.19244 1.120906   127.3697    67.4   76.08253 1.954689          ?        ? 
1 1 1   17   17   10 o 27.00502 1.893080   50.96763   228.9   7.307531 1.022453          ?        ? 
1 1 1   17   17   11 o 52.29041 1.121442   35.03593   237.5   27.36565 1.172814          ?        ? 
1 1 1   17   17   12 o 34.14063 1.101040   34.38258    62.7   11.66799 0.7518036          ?        ? 
1 1 1   17   17   13 o 39.21737 0.9968488   53.29995    71.9   15.39694 0.7818757          ?        ? 
1 1 1   17   17   14 o 63.60216 0.9456329   66.83798   252.0   40.50718 1.202886          ?        ? 
1 1 1   17   17   15 f 70.28621 0.9412760   54.73582   214.3   49.49875 1.323174          ?        ? 
1 1 1   17   17   16 o 20.58832 1.606705   39.44225   335.3   4.270245 0.6615872          ?        ? 
1 1 1   17   17   17 o 30.28322 1.638499   32.64542   268.2   9.262220 0.9923807          ?        ? 
1 1 1   17   17   18 f 10.40009 3.685016   10.41621   247.1   1.052525 0.9623086          ?        ? 
1 1 1   17   17   19 o 16.11916 3.373725   17.29543   172.0   2.886926 1.052525          ?        ? 
1 1 1   17   17   20 o 15.83497 3.755286   12.44077   288.0   2.947070 1.172814          ?        ? 
1 1 1   17   18    0 o 97.03419 1.659118   139.1539     0.0   94.27618 3.217719   94.27618 3.217719 
1 1 1   17   18    1 o 141.5486 1.487157   167.8231   339.0   200.4910 4.210100          ?        ? 
1 1 1   17   18    2 o 80.66611 1.323432   104.0202   294.2   65.10619 2.135122          ?        ? 
1 1 1   17   18    3 o 133.5943 1.463153   171.7134   352.5   178.5985 3.909379          ?        ? 
1 1 1   17   18    4 o 93.31339 1.256855   93.29806   356.5   87.11900 2.345627          ?        ? 
1 1 1   17   18    5 f 79.44369 1.211309   129.4219   258.6   63.15150 1.924617          ?        ? 
1 1 1   17   18    6 o 63.70053 1.109403   51.65459    74.1   40.59740 1.413391          ?        ? 
1 1 1   17   18    7 f 99.32869 1.165602   100.8708   189.9   98.72684 2.315555          ?        ? 
1 1 1   17   18    8 o 42.42385 1.275930   60.53322   252.9   18.01322 1.082597          ?        ? 
1 1 1   17   18    9 o 33.02007 1.457157   37.18130   105.9   10.91619 0.9623086          ?        ? 
1 1 1   17   18   10 o 67.53644 1.135446   66.85733    10.6   45.64952 1.533679          ?        ? 
1 1 1   17   18   11 o 129.1821 1.291978   148.7401   277.8   167.0808 3.338008          ?        ? 
1 1 1   17   18   12 o 38.16969 1.063603   46.22198   113.7   14.58499 0.8119479          ?        ? 
1 1 1   17   18   13 o 29.55520 1.220989   30.01343     2.7   8.750995 0.7217315          ?        ? 
1 1 1   17   18   14 o 48.79949 0.9551703   54.40750    82.1   23.84721 0.9322364          ?        ? 
1 1 1   17   18   15 o 45.63284 0.9885034   61.37819    10.0   20.87007 0.9021643          ?        ? 
1 1 1   17   18   16 f 28.14022 1.442682   26.59504     6.5   7.969118 0.8119479          ?        ? 
1 1 1   17   18   17 o 5.673829 2.615524   18.37977   356.4 -0.5112265 0.6916593          ?        ? 
1 1 1   17   18   18 o 13.41367 3.695280   11.92061   163.5   2.014834 1.022453          ?        ? 
1 1 1   17   18   19 o 17.19198 3.085640   13.85929   210.0   3.247792 1.022453          ?        ? 
1 1 1   17   18   20 o 23.48177 2.561319   20.92669   312.3   5.924213 1.202886          ?        ? 
1 1 1   17   19    0 o 4.768010 3.379014   15.57129   360.0  -1.323174 1.232958  -1.323174 1.232958 
1 1 1   17   19    1 o 165.6049 1.570751   210.7275   343.1   274.4685 5.202481          ?        ? 
1 1 1   17   19    2 o 56.86440 1.454309   80.21056   322.3   32.35763 1.653968          ?        ? 
1 1 1   17   19    3 o 82.30999 1.187395   121.4298    15.1   67.78262 1.954689          ?        ? 
1 1 1   17   19    4 o 87.17645 1.310837   123.3018   131.4   76.05245 2.285483          ?        ? 
1 1 1   17   19    5 o 91.46906 1.282197   144.6147    88.9   83.72085 2.345627          ?        ? 
1 1 1   17   19    6 o 143.1728 1.543801   217.6909    56.0   205.2123 4.420605          ?        ? 
1 1 1   17   19    7 o 95.97607 1.143653   140.0162    43.9   92.17113 2.195267          ?        ? 
1 1 1   17   19    8 o 67.11515 1.120170   81.11288   101.5   45.07814 1.503607          ?        ? 
1 1 1   17   19    9 o 12.81755 3.360725   36.46180   331.9   1.714112 0.8720922          ?        ? 
1 1 1   17   19   10 o 106.8205 1.196462   146.1708   288.5   114.2140 2.556132          ?        ? 
1 1 1   17   19   11 o 7.100667 3.020739   32.63163    24.2   0.000000 0.7518036          ?        ? 
1 1 1   17   19   12 o 74.73302 0.9858663   75.02077   241.0   55.90411 1.473535          ?        ? 
1 1 1   17   19   13 o 48.61445 1.051594   41.00553    40.0   23.66678 1.022453          ?        ? 
1 1 1   17   19   14 o 19.00935 1.898359   27.78481   238.0   3.638730 0.7217315          ?        ? 
1 1 1   17   19   15 o 41.11983 1.096994   44.52575   169.0   16.96069 0.9021643          ?        ? 
1 1 1   17   19   16 o 53.42884 1.069405   52.04057   187.6   28.65875 1.142741          ?        ? 
1 1 1   17   19   17 o 6.704617 2.937925   10.14956   193.8 -0.1202886 0.7518036          ?        ? 
1 1 1   17   19   18 o 21.59482 2.019216   22.24032   208.5   4.781471 0.8720922          ?        ? 
1 1 1   17   19   19 o 43.34216 1.248896   38.34221   237.4   19.03567 1.082597          ?        ? 
1 1 1   17   19   20 o 9.105565 3.844876   12.01310   273.3  0.4811543 1.202886          ?        ? 
1 1 1   17   20    0 o 128.7633 1.951111   156.0571    -0.0   166.0283 5.022048   166.0283 5.022048 
1 1 1   17   20    1 o 86.99442 1.209876   113.6266    67.0   75.72166 2.105050          ?        ? 
1 1 1   17   20    2 o 184.8822 1.707885   204.5913    21.1   342.2210 6.315150          ?        ? 
1 1 1   17   20    3 o 35.64528 1.645118   18.03345    90.1   12.72052 1.172814          ?        ? 
1 1 1   17   20    4 o 37.69489 1.635445   45.07515     3.3   14.22412 1.232958          ?        ? 
1 1 1   17   20    5 o 162.6694 1.626827   193.3347   213.3   264.9356 5.292697          ?        ? 
1 1 1   17   20    6 o 50.38295 1.492179   40.31988   159.1   25.41096 1.503607          ?        ? 
1 1 1   17   20    7 o 105.7654 1.378995   113.6470   121.9   111.9887 2.916998          ?        ? 
1 1 1   17   20    8 o 17.30445 2.780524   14.92403   150.0   3.007215 0.9623086          ?        ? 
1 1 1   17   20    9 o 10.77241 3.800295   19.84234   239.1   1.022453 1.022453          ?        ? 
1 1 1   17   20   10 o 79.22164 1.157765   56.66170    88.5   62.82071 1.834401          ?        ? 
1 1 1   17   20   11 o 84.50612 1.014194   94.17726    53.3   71.48148 1.714112          ?        ? 
1 1 1   17   20   12 o 40.55841 1.223397   54.06022   249.2   16.47953 0.9923807          ?        ? 
1 1 1   17   20   13 o 75.75243 0.9725993   83.46867   226.6   57.46787 1.473535          ?        ? 
1 1 1   17   20   14 o 31.77249 1.325077   37.39412   164.0   10.13431 0.8420200          ?        ? 
1 1 1   17   20   15 o 49.03831 1.011842   52.76163   129.5   24.11786 0.9923807          ?        ? 
1 1 1   17   20   16 o 21.87539 1.787113   23.69535   260.8   4.841615 0.7818757          ?        ? 
1 1 1   17   20   17 f 20.82074 1.949854   25.28669   220.5   4.420605 0.8119479          ?        ? 
1 1 1   17   20   18 o 9.841317 3.451000   16.21721   171.4  0.9623086 0.8420200          ?        ? 
1 1 1   17   20   19 o 35.96816 1.421331   37.65020     2.1   13.17160 1.022453          ?        ? 
1 1 1   17   20   20 o 20.34331 2.439085   22.93901   200.9   4.450677 0.9923807          ?        ? 
1 1 1   17   21    0 o 41.17584 1.944664   59.39468     0.0   17.08098 1.593824   17.08098 1.593824 
1 1 1   17   21    1 o 84.96626 1.167970   100.4477   145.2   72.23329 1.984761          ?        ? 
1 1 1   17   21    2 o 194.2844 1.733583   216.0869    92.9   377.9166 6.736160          ?        ? 
1 1 1   17   21    3 o 99.19664 1.182312   100.2506   346.1   98.45620 2.345627          ?        ? 
1 1 1   17   21    4 f 81.54562 1.290719   106.3237   126.4   66.54966 2.105050          ?        ? 
1 1 1   17   21    5 o 83.14918 1.338161   112.3488   162.7   69.19601 2.225339          ?        ? 
1 1 1   17   21    6 o 115.8632 1.401563   152.9201   314.0   134.3924 3.247792          ?        ? 
1 1 1   17   21    7 o 63.86993 1.388961   59.08986   140.3   40.83797 1.774257          ?        ? 
1 1 1   17   21    8 o 75.05309 1.282171   78.65784   297.9   56.38527 1.924617          ?        ? 
1 1 1   17   21    9 o 65.13165 1.200454   52.43768   224.9   42.46187 1.563751          ?        ? 
1 1 1   17   21   10 o 74.63744 1.007274   64.24507   233.1   55.75375 1.503607          ?        ? 
1 1 1   17   21   11 o 46.47019 1.132473   44.95102   196.6   21.62187 1.052525          ?        ? 
1 1 1   17   21   12 o 6.260575 2.864313   16.37918    76.3 -0.5713707 0.8119479          ?        ? 
1 1 1   17   21   13 o 25.66512 1.640398   41.26607    41.3   6.615872 0.8420200          ?        ? 
1 1 1   17   21   14 o 47.62076 1.041962   41.16898   153.7   22.73454 0.9923807          ?        ? 
1 1 1   17   21   15 o 15.07425 2.493668   24.89640    60.8   2.315555 0.7518036          ?        ? 
1 1 1   17   21   16 o 39.91743 1.205374   42.46093    85.6   16.02845 0.9623086          ?        ? 
1 1 1   17   21   17 o 21.20963 1.984995   25.69499    94.7   4.601038 0.8420200          ?        ? 
1 1 1   17   21   18 o 19.45634 2.395714   21.60538   294.1   3.939451 0.9322364          ?        ? 
1 1 1   17   21   19 o 12.43698 3.639277   11.71231   216.4   1.804329 0.9623086          ?        ? 
1 1 1   17   22    0 o 67.19109 1.680688   78.94997   180.0   45.25858 2.255411   45.25858 2.255411 
1 1 1   17   22    1 o 105.5328 1.239556   87.85790    98.8   111.4474 2.616277          ?        ? 
1 1 1   17   22    2 o 97.23273 1.206192   101.9650   244.2   94.60697 2.345627          ?        ? 
1 1 1   17   22    3 o 143.3519 1.405516   151.3152    86.3   205.6935 4.029667          ?        ? 
1 1 1   17   22    4 o 80.60621 1.175186   82.45430    15.4   65.01598 1.894545          ?        ? 
1 1 1   17   22    5 o 82.23463 1.316474   83.78643   325.8   67.69240 2.165194          ?        ? 
1 1 1   17   22    6 o 26.08577 2.363277   37.47294     5.9   6.826377 1.232958          ?        ? 
1 1 1   17   22    7 o 102.9590 1.401979   118.2135   226.7   106.1246 2.886926          ?        ? 
1 1 1   17   22    8 o 117.7618 1.340661   106.7543   102.5   138.8431 3.157575          ?        ? 
1 1 1   17   22    9 o 26.46571 2.499790   8.559325    23.7   7.036882 1.323174          ?        ? 
1 1 1   17   22   10 o 65.54524 1.009360   63.68453   113.8   43.00317 1.323174          ?        ? 
1 1 1   17   22   11 o 22.88742 1.970874   37.61761     7.3   5.262625 0.9021643          ?        ? 
1 1 1   17   22   12 o 25.13264 1.734979   17.26284   210.3   6.345222 0.8720922          ?        ? 
1 1 1   17   22   13 o 7.125314 3.057367   10.58262   180.7      -0.03 0.7818757          ?        ? 
1 1 1   17   22   14 f 39.95722 1.204174   42.34800   180.8   16.02845 0.9623086          ?        ? 
1 1 1   17   22   15 o 16.89624 2.491739   8.639370   355.7   2.916998 0.8420200          ?        ? 
1 1 1   17   22   16 o 37.28007 1.290648   37.24776   150.2   14.01362 0.9623086          ?        ? 
1 1 1   17   22   17 o 21.34322 2.183918   29.88864   157.8   4.691255 0.9322364          ?        ? 
1 1 1   17   22   18 o 6.678274 3.028338   14.21265   232.1 -0.3608657 0.8720922          ?        ? 
1 1 1   17   22   19 o 18.83757 2.554227   19.90076    42.6   3.819162 0.9623086          ?        ? 
1 1 1   17   23    0 o 13.57417 5.856797   14.17464   180.0   2.646349 1.623896   2.646349 1.623896 
1 1 1   17   23    1 o 70.41956 1.131663   64.14365   287.1   49.61904 1.593824          ?        ? 
1 1 1   17   23    2 o 172.8021 1.688057   173.9432   281.5   299.0073 5.833996          ?        ? 
1 1 1   17   23    3 o 51.76730 1.365138   34.76936   253.3   26.82435 1.413391          ?        ? 
1 1 1   17   23    4 o 54.56458 1.267598   81.61453   273.2   29.80149 1.383319          ?        ? 
1 1 1   17   23    5 o 97.61195 1.201506   108.3594    12.2   95.35877 2.345627          ?        ? 
1 1 1   17   23    6 o 45.18806 1.597173   46.70763   271.1   20.44906 1.443463          ?        ? 
1 1 1   17   23    7 o 118.8146 1.467989   110.3239   289.7   141.3692 3.488369          ?        ? 
1 1 1   17   23    8 o 107.9285 1.421015   128.0159   274.0   116.6498 3.067359          ?        ? 
1 1 1   17   23    9 o 66.49591 1.130601   75.92822    92.1   44.26620 1.503607          ?        ? 
1 1 1   17   23   10 o 48.08264 1.250852   56.09409   282.0   23.15555 1.202886          ?        ? 
1 1 1   17   23   11 o 58.27628 1.109459   67.54234   126.9   34.01160 1.293102          ?        ? 
1 1 1   17   23   12 o 98.26095 1.025246   114.9217   161.6   96.71202 2.014834          ?        ? 
1 1 1   17   23   13 o 52.39244 1.033162   46.67555   153.3   27.51601 1.082597          ?        ? 
1 1 1   17   23   14 o 28.59414 1.630118   24.39152   328.8   8.239767 0.9322364          ?        ? 
1 1 1   17   23   15 o 15.24287 2.867342   14.28537   333.4   2.465916 0.8420200          ?        ? 
1 1 1   17   23   16 o 27.29299 1.597649   26.42142   197.8   7.548109 0.8720922          ?        ? 
1 1 1   17   23   17 o 16.56554 2.541481   22.75433   124.7   2.856854 0.8420200          ?        ? 
1 1 1   17   23   18 o 28.93320 1.870856   30.46853   255.8   8.630706 1.082597          ?        ? 
1 1 1   17   23   19 o 10.06214 3.722833   5.690842    38.3   1.082597 0.9923807          ?        ? 
1 1 1   17   24    0 o 21.50022 3.839703   16.12072   180.0   5.022048 1.503607   5.022048 1.503607 
1 1 1   17   24    1 o 65.75804 1.143288   76.29932   237.1   43.27382 1.503607          ?        ? 
1 1 1   17   24    2 f 63.85129 1.248075   66.93645   135.5   40.80790 1.593824          ?        ? 
1 1 1   17   24    3 o 125.8849 1.313873   135.8415     0.2   158.6306 3.307936          ?        ? 
1 1 1   17   24    4 o 65.73324 1.212342   88.06950   171.1   43.24374 1.593824          ?        ? 
1 1 1   17   24    5 o 68.50690 1.229102   99.70813   249.3   46.97269 1.684040          ?        ? 
1 1 1   17   24    6 o 16.42587 3.577955   22.14532   347.2   2.826782 1.142741          ?        ? 
1 1 1   17   24    7 o 81.26341 1.424722   56.42053    73.5   66.12865 2.315555          ?        ? 
1 1 1   17   24    8 o 56.35275 1.520877   73.02467   342.9   31.81633 1.714112          ?        ? 
1 1 1   17   24    9 o 49.85729 1.326962   68.67805    24.5   24.89974 1.323174          ?        ? 
1 1 1   17   24   10 o 26.06590 1.961285   37.28999   300.6   6.826377 1.022453          ?        ? 
1 1 1   17   24   11 o 67.08567 1.031009   66.92931    84.1   45.07814 1.383319          ?        ? 
1 1 1   17   24   12 o 25.45928 1.771779   25.19182     1.3   6.525656 0.9021643          ?        ? 
1 1 1   17   24   13 o 23.80640 1.768474   35.68895   276.6   5.713707 0.8420200          ?        ? 
1 1 1   17   24   14 f 10.76266 3.520652   12.73353   222.4   1.172814 0.8720922          ?        ? 
1 1 1   17   24   15 o 7.113883 3.084985   8.877885    14.5      -0.06 0.8119479          ?        ? 
1 1 1   17   24   16 o 8.104675 3.337533   10.57898     1.6  0.3007214 0.8720922          ?        ? 
1 1 1   17   24   17 o 6.712872 3.036997   14.88704    67.7 -0.3608657 0.8720922          ?        ? 
1 1 1   17   24   18 o 7.929638 3.368285   9.722466    76.6  0.2105050 0.9322364          ?        ? 
1 1 1   17   25    0 o 76.37612 1.655428   86.90040     0.0   58.46025 2.526060   58.46025 2.526060 
1 1 1   17   25    1 o 29.84990 2.065263   21.75103   327.6   8.931427 1.232958          ?        ? 
1 1 1   17   25    2 o 67.77991 1.242286   67.24706   279.7   45.98031 1.684040          ?        ? 
1 1 1   17   25    3 o 112.2391 1.286061   113.9956    98.1   126.0925 2.886926          ?        ? 
1 1 1   17   25    4 o 95.60229 1.211035   99.92744   183.7   91.47947 2.315555          ?        ? 
1 1 1   17   25    5 o 137.0607 1.316445   131.7378   244.7   188.0712 3.608657          ?        ? 
1 1 1   17   25    6 o 41.00397 1.540131   48.66278   180.0   16.84040 1.263030          ?        ? 
1 1 1   17   25    7 o 35.74557 1.808759   44.25225    42.9   12.81073 1.293102          ?        ? 
1 1 1   17   25    8 f 27.88381 2.426581   47.85166   225.9   7.818758 1.353247          ?        ? 
1 1 1   17   25    9 o 12.94232 3.943181   29.84661   229.8   1.714112 1.112669          ?        ? 
1 1 1   17   25   10 o 45.00194 1.336482   36.50612   155.2   20.29870 1.202886          ?        ? 
1 1 1   17   25   11 o 25.63161 2.053178   31.99329   325.0   6.615872 1.052525          ?        ? 
1 1 1   17   25   12 o 8.688165 3.461776   5.991505   320.5  0.4210100 0.9021643          ?        ? 
1 1 1   17   25   13 f 22.75389 1.916358   30.67870   288.2   5.232553 0.8720922          ?        ? 
1 1 1   17   25   14 o 20.38368 2.360488   30.03293   218.6   4.240172 0.9623086          ?        ? 
1 1 1   17   25   15 o 44.19149 1.292943   47.96588   196.5   19.69725 1.142741          ?        ? 
1 1 1   17   25   16 o 7.312458 3.211205   9.169691   355.2 -0.1202886 0.9021643          ?        ? 
1 1 1   17   25   17 o 24.06143 1.999691   24.08875   157.9   5.984357 0.9623086          ?        ? 
1 1 1   17   25   18 o 12.63406 3.545657   24.09714   168.4   1.894545 0.9322364          ?        ? 
1 1 1   17   26    0 o 5.674199 3.951660   16.13537   360.0  -1.232958 1.533679  -1.232958 1.533679 
1 1 1   17   26    1 o 75.25352 1.278756   87.69664   228.6   56.68599 1.924617          ?        ? 
1 1 1   17   26    2 o 159.3169 1.491178   169.4810   350.9   254.1698 4.751399          ?        ? 
1 1 1   17   26    3 o 97.23038 1.268079   95.39246   174.7   94.63705 2.465916          ?        ? 
1 1 1   17   26    4 o 83.23661 1.174177   89.02879   158.9   69.34637 1.954689          ?        ? 
1 1 1   17   26    5 o 136.2318 1.401714   126.0042    40.8   185.8459 3.819162          ?        ? 
1 1 1   17   26    6 o 9.801297 3.898992   9.827874   287.6  0.5112265 1.142741          ?        ? 
1 1 1   17   26    7 o 28.16595 2.188739   34.39819   328.1   7.969118 1.232958          ?        ? 
1 1 1   17   26    8 o 64.93572 1.111455   84.79610    11.2   42.22129 1.443463          ?        ? 
1 1 1   17   26    9 o 55.00488 1.257451   64.62577   223.0   30.31272 1.383319          ?        ? 
1 1 1   17   26   10 f 51.19250 1.380466   82.18700   335.1   26.28305 1.413391          ?        ? 
1 1 1   17   26   11 o 34.79501 1.642105   50.51503    58.2   12.17922 1.142741          ?        ? 
1 1 1   17   26   12 o 15.86766 3.239142   3.102217   200.1   2.676421 0.9923807          ?        ? 
1 1 1   17   26   13 o 5.776713 2.731134   9.011153   113.4 -0.9623086 0.8420200          ?        ? 
1 1 1   17   26   14 o 11.74641 3.811871   19.97687    34.8   1.443463 1.022453          ?        ? 
1 1 1   17   26   15 o 25.50939 1.945129   38.41320   205.5   6.645944 0.9923807          ?        ? 
1 1 1   17   26   16 o 25.02175 2.043128   29.93964    74.1   6.435439 1.022453          ?        ? 
1 1 1   17   26   17 o 6.997029 3.154107   11.83641   299.6 -0.3007214 0.9322364          ?        ? 
1 1 1   17   26   18 o 7.560127 3.318264   4.399801   247.9       0.03 0.9623086          ?        ? 
1 1 1   17   27    0 o 32.73645 2.794943   87.36521   180.0   10.97633 1.804329   10.97633 1.804329 
1 1 1   17   27    1 o 23.53352 2.619578   35.94009   180.6   5.563347 1.232958          ?        ? 
1 1 1   17   27    2 o 26.30876 2.343246   26.93709    78.1   6.946666 1.232958          ?        ? 
1 1 1   17   27    3 o 108.3042 1.291137   125.9440    41.1   117.4317 2.796710          ?        ? 
1 1 1   17   27    4 o 60.63381 1.264706   57.52777   250.0   36.80830 1.533679          ?        ? 
1 1 1   17   27    5 o 115.5018 1.249732   101.3796   201.6   133.5805 2.886926          ?        ? 
1 1 1   17   27    6 o 32.65580 2.025941   36.66850   327.9   10.70568 1.323174          ?        ? 
1 1 1   17   27    7 o 73.50999 1.288631   73.15046   269.8   54.12986 1.894545          ?        ? 
1 1 1   17   27    8 o 36.77103 1.594752   24.05193   190.5   13.56254 1.172814          ?        ? 
1 1 1   17   27    9 o 38.56894 1.325488   42.76001   272.3   14.91578 1.022453          ?        ? 
1 1 1   17   27   10 o 46.94717 1.185023   59.44877     6.6   22.10303 1.112669          ?        ? 
1 1 1   17   27   11 o 12.76305 3.756594   20.03111   150.1   1.714112 1.022453          ?        ? 
1 1 1   17   27   12 o 16.25117 3.072674   5.716550   333.5   2.796710 0.9623086          ?        ? 
1 1 1   17   27   13 o 24.31933 1.793002   17.55889   321.3   5.984357 0.8720922          ?        ? 
1 1 1   17   27   14 o 24.41902 1.908832   35.14138    69.7   6.074574 0.9322364          ?        ? 
1 1 1   17   27   15 o 62.15700 1.185333   54.42234     7.8   38.97350 1.473535          ?        ? 
1 1 1   17   27   16 o 12.79696 3.605958   14.59506   316.9   1.864473 0.9623086          ?        ? 
1 1 1   17   27   17 o 7.357955 3.287664   16.97627   232.1 -0.1804329 0.9923807          ?        ? 
1 1 1   17   28    0 o 17.23241 6.208910   8.788966   180.0   3.969523 1.954689   3.969523 1.954689 
1 1 1   17   28    1 o 74.15768 1.297652   41.32199   281.7   55.06210 1.924617          ?        ? 
1 1 1   17   28    2 o 94.58610 1.319427   118.9204   146.3   89.58492 2.495988          ?        ? 
1 1 1   17   28    3 o 51.97766 1.475325   65.78423   314.5   27.06493 1.533679          ?        ? 
1 1 1   17   28    4 o 124.2181 1.392026   113.4561    55.7   154.5708 3.458297          ?        ? 
1 1 1   17   28    5 o 62.03560 1.357317   45.69344   264.9   38.55249 1.684040          ?        ? 
1 1 1   17   28    6 o 73.87724 1.261872   76.89701   310.6   54.67116 1.864473          ?        ? 
1 1 1   17   28    7 o 30.54446 2.165981   22.36024   182.8   9.382509 1.323174          ?        ? 
1 1 1   17   28    8 o 20.93169 2.442356   19.66465   250.3   4.420605 1.022453          ?        ? 
1 1 1   17   28    9 o 72.79462 1.115396   78.93114    89.6   53.10741 1.623896          ?        ? 
1 1 1   17   28   10 o 51.04047 1.178365   53.22577   163.1   26.13269 1.202886          ?        ? 
1 1 1   17   28   11 o 19.44148 2.552225   17.01875   205.8   3.849235 0.9923807          ?        ? 
1 1 1   17   28   12 o 22.79722 2.308450   22.20941   186.8   5.292697 1.052525          ?        ? 
1 1 1   17   28   13 o 10.60513 3.743716   18.55121    68.6   1.082597 0.9923807          ?        ? 
1 1 1   17   28   14 o 24.70475 1.886755   24.76691   316.4   6.224934 0.9322364          ?        ? 
1 1 1   17   28   15 o 16.88459 3.232086   8.531588   204.6   3.127503 1.052525          ?        ? 
1 1 1   17   28   16 o 13.05850 3.871818   10.99173    75.9   1.984761 1.082597          ?        ? 
1 1 1   17   28   17 o 14.61699 3.615674   10.67085   121.7   2.556132 1.052525          ?        ? 
1 1 1   17   29    0 o 67.11287 1.772667   95.76985   180.0   45.19843 2.375700   45.19843 2.375700 
1 1 1   17   29    1 o 39.40856 1.831408   36.95935    36.7   15.57737 1.443463          ?        ? 
1 1 1   17   29    2 o 80.83272 1.264900   84.59542   115.3   65.43699 2.044906          ?        ? 
1 1 1   17   29    3 o 48.68754 1.513257   61.31651   270.2   23.75699 1.473535          ?        ? 
1 1 1   17   29    4 o 68.30601 1.276743   83.22051    46.5   46.73211 1.744184          ?        ? 
1 1 1   17   29    5 o 8.320966 3.676852   15.32447   305.7 -0.3608657 1.202886          ?        ? 
1 1 1   17   29    6 o 63.20366 1.284653   54.02221   143.3   40.02603 1.623896          ?        ? 
1 1 1   17   29    7 o 46.54785 1.518213   54.80623    65.7   21.74216 1.413391          ?        ? 
1 1 1   17   29    8 o 48.35923 1.336976   46.70130    33.8   23.45627 1.293102          ?        ? 
1 1 1   17   29    9 o 40.46816 1.411902   41.34752   125.9   16.44946 1.142741          ?        ? 
1 1 1   17   29   10 o 36.96030 1.505222   43.74247   107.0   13.74297 1.112669          ?        ? 
1 1 1   17   29   11 o 18.30623 2.710500   18.30460   153.3   3.428224 0.9923807          ?        ? 
1 1 1   17   29   12 o 15.37325 3.415174   23.57437   118.1   2.556132 1.022453          ?        ? 
1 1 1   17   29   13 o 28.33707 1.697968   34.82634    86.6   8.149551 0.9623086          ?        ? 
1 1 1   17   29   14 o 11.13987 3.812092   10.20722   139.0   1.293102 1.022453          ?        ? 
1 1 1   17   29   15 o 9.545554 3.759306   8.774863   135.7  0.7217315 1.052525          ?        ? 
1 1 1   17   29   16 o 18.43837 2.935718   23.50401   173.5   3.698874 1.082597          ?        ? 
1 1 1   17   29   17 o 28.62271 1.943683   30.29088    76.2   8.600634 1.112669          ?        ? 
1 1 1   17   30    0 o 59.30412 2.033571   105.3922   180.0   35.36484 2.405771   35.36484 2.405771 
1 1 1   17   30    1 o 41.91727 1.721800   51.86856   335.6   17.62228 1.443463          ?        ? 
1 1 1   17   30    2 o 75.34393 1.297178   85.44004   284.3   56.86643 1.954689          ?        ? 
1 1 1   17   30    3 o 44.98982 1.570790   39.53614   107.6   20.29870 1.413391          ?        ? 
1 1 1   17   30    4 o 85.70590 1.210522   93.17146   164.7   73.58654 2.074978          ?        ? 
1 1 1   17   30    5 o 40.82061 1.657553   43.48329   102.4   16.72011 1.353247          ?        ? 
1 1 1   17   30    6 o 81.98256 1.320521   88.86301   186.8   67.39168 2.165194          ?        ? 
1 1 1   17   30    7 o 20.70828 2.396097   15.40361   218.5   4.330389 0.9923807          ?        ? 
1 1 1   17   30    8 o 7.958573 3.402595   11.48668   261.6   0.000000 0.9623086          ?        ? 
1 1 1   17   30    9 o 73.80246 1.120537   80.62769   330.0   54.64109 1.653968          ?        ? 
1 1 1   17   30   10 o 52.13567 1.240132   53.24551   359.0   27.30551 1.293102          ?        ? 
1 1 1   17   30   11 o 21.30919 2.328528   19.30133    31.2   4.631110 0.9923807          ?        ? 
1 1 1   17   30   12 o 41.18153 1.350933   40.95372   324.1   17.11105 1.112669          ?        ? 
1 1 1   17   30   13 o 13.54076 3.601034   15.88614    16.9   2.044906 0.9923807          ?        ? 
1 1 1   17   30   14 o 18.37083 2.782816   16.32622   250.4   3.548513 1.022453          ?        ? 
1 1 1   17   30   15 o 8.495412 3.534280   6.019800    18.7  0.3608657 0.9923807          ?        ? 
1 1 1   17   30   16 o 12.98845 3.807777   19.34417   280.6   2.044906 1.052525          ?        ? 
1 1 1   17   31    0 o 43.01315 2.535225   40.45969   180.0   18.76502 2.165194   18.76502 2.165194 
1 1 1   17   31    1 o 127.4172 1.475083   105.1590   102.0   162.7805 3.759018          ?        ? 
1 1 1   17   31    2 o 29.33582 2.306475   27.86677   227.3   8.660777 1.353247          ?        ? 
1 1 1   17   31    3 f 62.96033 1.313500   65.93274   236.0   39.72530 1.653968          ?        ? 
1 1 1   17   31    4 o 34.43641 2.139502   58.13788   236.7   11.93864 1.473535          ?        ? 
1 1 1   17   31    5 o 56.50651 1.410301   49.29812    33.2   32.02683 1.593824          ?        ? 
1 1 1   17   31    6 o 32.89689 2.148214   55.83162   208.8   10.91619 1.413391          ?        ? 
1 1 1   17   31    7 o 50.01273 1.322838   65.85149   282.5   25.11024 1.323174          ?        ? 
1 1 1   17   31    8 o 23.43954 2.245191   42.30608   286.6   5.563347 1.052525          ?        ? 
1 1 1   17   31    9 f 25.33641 2.017754   27.60532   357.4   6.495584 1.022453          ?        ? 
1 1 1   17   31   10 o 36.14854 1.497428   33.99768   211.4   13.17160 1.082597          ?        ? 
1 1 1   17   31   11 o 34.91092 1.636654   34.30791     9.4   12.32958 1.142741          ?        ? 
1 1 1   17   31   12 o 30.09316 1.748778   24.57346   133.7   9.202076 1.052525          ?        ? 
1 1 1   17   31   13 o 7.830230 3.403324   4.936707   355.6      -0.03 0.9923807          ?        ? 
1 1 1   17   31   14 o 9.008901 3.579789   6.753302    76.5  0.6014429 0.9623086          ?        ? 
1 1 1   17   31   15 o 13.06297 3.999368   7.436572    43.0   2.044906 1.142741          ?        ? 
1 1 1   17   31   16 o 13.01735 3.732747   22.21192     2.2   2.074978 1.022453          ?        ? 
1 1 1   17   32    0 o 55.08537 2.136067   69.71377    -0.0   30.58337 2.345627   30.58337 2.345627 
1 1 1   17   32    1 o 88.67958 1.322530   68.19484    37.2   78.84917 2.345627          ?        ? 
1 1 1   17   32    2 o 48.29562 1.681204   64.37568   173.9   23.42620 1.623896          ?        ? 
1 1 1   17   32    3 o 70.42262 1.387828   76.25278   318.5   49.73933 1.954689          ?        ? 
1 1 1   17   32    4 o 37.11899 1.903865   44.96089   273.5   13.86326 1.413391          ?        ? 
1 1 1   17   32    5 o 91.62450 1.312843   83.47711   134.0   84.26215 2.405771          ?        ? 
1 1 1   17   32    6 o 47.98804 1.566648   65.09011   171.6   23.15555 1.503607          ?        ? 
1 1 1   17   32    7 o 37.12077 1.539221   35.65176    55.1   13.86326 1.142741          ?        ? 
1 1 1   17   32    8 o 37.30074 1.572105   38.93328   100.8   14.01362 1.172814          ?        ? 
1 1 1   17   32    9 o 22.24906 2.432905   16.01600    76.0   5.052120 1.082597          ?        ? 
1 1 1   17   32   10 o 35.89500 1.633673   40.74262   226.5   13.02124 1.172814          ?        ? 
1 1 1   17   32   11 o 36.67946 1.557740   51.35212    52.3   13.62268 1.142741          ?        ? 
1 1 1   17   32   12 o 10.28159 3.782771   18.36398   159.6  0.9923807 1.022453          ?        ? 
1 1 1   17   32   13 o 21.55485 2.441504   19.40582   206.4   4.841615 1.052525          ?        ? 
1 1 1   17   32   14 o 8.705853 3.602461   11.73611    46.9  0.4210100 1.022453          ?        ? 
1 1 1   17   32   15 o 10.75039 3.898537   12.56780   263.8   1.293102 1.082597          ?        ? 
1 1 1   17   33    0 o 73.18189 2.078868   84.17731    -0.0   53.88928 3.037287   53.88928 3.037287 
1 1 1   17   33    1 o 57.68955 1.459571   49.28056   187.8   33.41015 1.684040          ?        ? 
1 1 1   17   33    2 o 12.03582 4.270966   15.85315   178.4   1.323174 1.293102          ?        ? 
1 1 1   17   33    3 o 16.47874 3.965659   27.92387    99.0   2.916998 1.293102          ?        ? 
1 1 1   17   33    4 o 56.69649 1.458616   50.52820    44.0   32.29749 1.653968          ?        ? 
1 1 1   17   33    5 o 23.61440 2.865300   15.85899     2.2   5.683635 1.353247          ?        ? 
1 1 1   17   33    6 o 12.10925 4.273590   14.76023   184.2   1.383319 1.293102          ?        ? 
1 1 1   17   33    7 o 46.54612 1.292144   43.91827    69.8   21.77223 1.202886          ?        ? 
1 1 1   17   33    8 f 17.28250 3.251477   34.42334   181.0   3.187647 1.082597          ?        ? 
1 1 1   17   33    9 o 66.67838 1.150058   66.52856   154.7   44.68721 1.533679          ?        ? 
1 1 1   17   33   10 o 27.71511 2.061586   25.41001   323.3   7.848830 1.142741          ?        ? 
1 1 1   17   33   11 o 24.56664 2.264594   24.29446   349.8   6.224934 1.112669          ?        ? 
1 1 1   17   33   12 o 34.07637 1.764985   33.11502   185.6   11.84843 1.202886          ?        ? 
1 1 1   17   33   13 o 9.958138 3.759082   13.41119   252.3  0.9322364 1.022453          ?        ? 
1 1 1   17   33   14 f 10.70577 3.847781   12.72691    34.8   1.263030 1.052525          ?        ? 
1 1 1   17   34    0 o 62.45038 1.930205   80.68603     0.0   39.27422 2.405771   39.27422 2.405771 
1 1 1   17   34    1 o 56.63743 1.486685   42.02414   128.5   32.23734 1.684040          ?        ? 
1 1 1   17   34    2 o 43.30258 1.770887   36.95195   210.5   18.88531 1.533679          ?        ? 
1 1 1   17   34    3 o 44.03082 1.673300   31.10374   169.9   19.51682 1.473535          ?        ? 
1 1 1   17   34    4 o 32.05141 2.204881   22.59727   260.9   10.40496 1.413391          ?        ? 
1 1 1   17   34    5 o 18.55071 3.778514   20.31535    19.2   3.698874 1.353247          ?        ? 
1 1 1   17   34    6 o 79.90737 1.279548   81.69306   321.8   64.17396 2.044906          ?        ? 
1 1 1   17   34    7 o 37.01812 1.624726   31.37089   304.8   13.83319 1.202886          ?        ? 
1 1 1   17   34    8 o 13.12098 3.795348   10.98216   334.6   1.864473 1.052525          ?        ? 
1 1 1   17   34    9 o 67.80444 1.197485   63.63311   232.3   46.31110 1.623896          ?        ? 
1 1 1   17   34   10 o 40.15963 1.460190   38.86254   203.7   16.32917 1.172814          ?        ? 
1 1 1   17   34   11 o 39.16410 1.574092   44.65141   203.1   15.57737 1.232958          ?        ? 
1 1 1   17   34   12 o 35.41862 1.528288   27.26852   101.2   12.78066 1.082597          ?        ? 
1 1 1   17   34   13 o 7.874466 3.482751   6.596769   192.9      -0.09 1.082597          ?        ? 
1 1 1   17   34   14 o 6.345314 3.004486   8.428738   123.9 -0.9322364 1.022453          ?        ? 
1 1 1   17   35    0 o 22.05362 4.925515   34.85140     0.0   5.653563 1.894545   5.653563 1.894545 
1 1 1   17   35    1 o 42.54173 1.767215   36.47021   328.0   18.25379 1.503607          ?        ? 
1 1 1   17   35    2 o 54.64863 1.568303   58.39700   111.5   30.07215 1.714112          ?        ? 
1 1 1   17   35    3 f 29.04863 2.329278   24.26553    51.3   8.570561 1.353247          ?        ? 
1 1 1   17   35    4 o 23.67509 2.857955   24.42989   346.9   5.743780 1.353247          ?        ? 
1 1 1   17   35    5 o 34.58046 2.000145   22.84574   182.7   12.11907 1.383319          ?        ? 
1 1 1   17   35    6 f 13.47230 4.332835   8.459540     9.5   1.924617 1.323174          ?        ? 
1 1 1   17   35    7 o 11.04754 3.909142   7.271432   315.4   1.172814 1.082597          ?        ? 
1 1 1   17   35    8 o 39.97963 1.541983   37.21839   159.0   16.17881 1.232958          ?        ? 
1 1 1   17   35    9 o 16.01467 3.648089   15.50297   136.4   2.856854 1.142741          ?        ? 
1 1 1   17   35   10 o 24.31516 2.288016   29.51143   325.4   6.104645 1.112669          ?        ? 
1 1 1   17   35   11 o 22.94306 2.293776   16.76587   234.1   5.473131 1.052525          ?        ? 
1 1 1   17   35   12 o 29.15419 1.805101   28.57452   233.6   8.750995 1.052525          ?        ? 
1 1 1   17   35   13 o 29.72018 1.871909   26.11285   232.4   9.202076 1.112669          ?        ? 
1 1 1   17   36    0 o 38.83693 2.657918   61.84506   180.0   15.45708 2.044906   15.45708 2.044906 
1 1 1   17   36    1 o 10.83342 4.151932   18.99062   120.4  0.9021643 1.263030          ?        ? 
1 1 1   17   36    2 o 39.09807 1.845952   49.61129    28.6   15.45708 1.443463          ?        ? 
1 1 1   17   36    3 o 55.74529 1.456532   54.93269   192.9   31.30510 1.623896          ?        ? 
1 1 1   17   36    4 o 33.67812 2.053735   39.15658   310.3   11.51763 1.383319          ?        ? 
1 1 1   17   36    5 o 24.86990 2.841569   27.56415    97.7   6.375295 1.413391          ?        ? 
1 1 1   17   36    6 o 9.751477 3.777871   9.211209   154.1  0.7217315 1.052525          ?        ? 
1 1 1   17   36    7 o 16.88466 3.501456   12.51207   109.6   3.127503 1.142741          ?        ? 
1 1 1   17   36    8 o 16.28852 3.345768   20.86295   219.8   2.916998 1.052525          ?        ? 
1 1 1   17   36    9 o 14.03953 3.849217   11.30495   242.3   2.225339 1.112669          ?        ? 
1 1 1   17   36   10 o 9.149730 3.798666   15.33430   255.0  0.4210100 1.142741          ?        ? 
1 1 1   17   36   11 f 9.614413 3.804322   8.774453    81.5  0.7518036 1.082597          ?        ? 
1 1 1   17   36   12 o 29.09291 1.963952   28.73844   168.0   8.841210 1.142741          ?        ? 
1 1 1   17   37    0 o 9.370515 5.699139   20.12320   180.0   1.022453 1.954689   1.022453 1.954689 
1 1 1   17   37    1 o 14.56114 4.269541   5.170547   232.7   2.315555 1.323174          ?        ? 
1 1 1   17   37    2 o 18.72700 4.048955   28.94458   295.1   3.849235 1.473535          ?        ? 
1 1 1   17   37    3 o 30.52032 2.414023   33.41214   284.7   9.532870 1.473535          ?        ? 
1 1 1   17   37    4 o 7.602710 3.567385   4.802146   287.3  -1.263030 1.383319          ?        ? 
1 1 1   17   37    5 o 27.13556 2.548904   14.72281    34.9   7.608253 1.383319          ?        ? 
1 1 1   17   37    6 o 12.55250 3.966851   10.53496   191.3   1.714112 1.112669          ?        ? 
1 1 1   17   37    7 o 8.769031 3.778144   8.176338   283.0       0.09 1.202886          ?        ? 
1 1 1   17   37    8 o 11.90852 3.922611   6.764770   324.8   1.533679 1.082597          ?        ? 
1 1 1   17   37    9 o 39.51460 1.598182   45.59483    11.7   15.90816 1.263030          ?        ? 
1 1 1   17   37   10 o 49.31583 1.463489   49.15034    83.4   24.77945 1.443463          ?        ? 
1 1 1   17   37   11 o 34.28993 1.797842   37.45287    51.8   12.17922 1.232958          ?        ? 
1 1 1   17   37   12 f 17.84214 3.408584   25.00043    14.2   3.728946 1.172814          ?        ? 
1 1 1   17   38    0 o 20.87660 5.596262   21.83759    -0.0   5.443058 2.014834   5.443058 2.014834 
1 1 1   17   38    1 o 20.29969 3.691780   13.18891   146.0   4.510822 1.443463          ?        ? 
1 1 1   17   38    2 o 24.55072 3.062247   29.81275   271.7   6.315150 1.503607          ?        ? 
1 1 1   17   38    3 o 20.23309 3.344143   9.229527    34.2   4.330389 1.353247          ?        ? 
1 1 1   17   38    4 o 15.82436 4.463152   21.57045   273.0   2.856854 1.473535          ?        ? 
1 1 1   17   38    5 o 18.76559 3.968277   21.42877   196.2   3.969523 1.443463          ?        ? 
1 1 1   17   38    6 o 8.319143 3.584285   6.305883   182.4       0.06 1.082597          ?        ? 
1 1 1   17   38    7 o 21.25224 2.830022   15.22502   134.9   4.751399 1.202886          ?        ? 
1 1 1   17   38    8 o 55.00940 1.284681   47.30532   331.5   30.64352 1.413391          ?        ? 
1 1 1   17   38    9 o 36.48717 1.771996   39.53743   356.3   13.68283 1.293102          ?        ? 
1 1 1   17   38   10 o 24.76153 2.428941   17.14553   285.1   6.525656 1.202886          ?        ? 
1 1 1   17   38   11 o 30.99207 2.037667   33.80789   122.9   10.10424 1.263030          ?        ? 
1 1 1   17   39    0 f 7.671026 5.079838   13.98017   360.0      -0.06 1.954689      -0.06 1.954689 
1 1 1   17   39    1 o 20.18900 4.163944   22.85253   103.5   4.601038 1.623896          ?        ? 
1 1 1   17   39    2 f 50.20064 1.677309   51.47734    80.2   25.62147 1.684040          ?        ? 
1 1 1   17   39    3 o 21.62248 3.129258   12.00192   274.4   4.961904 1.353247          ?        ? 
1 1 1   17   39    4 o 26.73471 2.643363   7.972102   223.7   7.457891 1.413391          ?        ? 
1 1 1   17   39    5 o 11.36158 4.419539   7.262560   267.9   1.112669 1.443463          ?        ? 
1 1 1   17   39    6 o 23.11136 2.602369   35.68550    44.8   5.593419 1.202886          ?        ? 
1 1 1   17   39    7 o 28.94501 2.129828   30.45892   192.1   8.690849 1.232958          ?        ? 
1 1 1   17   39    8 o 22.55587 2.666458   27.01807   148.4   5.412986 1.202886          ?        ? 
1 1 1   17   39    9 o 21.67549 2.913499   21.04897   162.8   5.142337 1.263030          ?        ? 
1 1 1   17   39   10 o 10.50846 3.931197   17.87895   142.0   1.202886 1.112669          ?        ? 
1 1 1   17   40    0 o 30.10154 3.475612   19.91869     0.0   9.743376 2.044906   9.743376 2.044906 
1 1 1   17   40    1 o 61.95934 1.480327   55.64434    28.9   38.91335 1.834401          ?        ? 
1 1 1   17   40    2 o 13.99102 4.475951   20.02989   160.2   2.225339 1.413391          ?        ? 
1 1 1   17   40    3 o 17.05788 4.243305   3.110204   325.8   3.368080 1.443463          ?        ? 
1 1 1   17   40    4 o 29.20769 2.676952   28.23890   114.2   8.961499 1.563751          ?        ? 
1 1 1   17   40    5 o 16.57855 4.378500   20.86392   307.6   3.277864 1.473535          ?        ? 
1 1 1   17   40    6 o 30.03559 2.052495   28.88609    86.3   9.352437 1.232958          ?        ? 
1 1 1   17   40    7 o 20.16943 3.280149   8.817290   260.3   4.480750 1.323174          ?        ? 
1 1 1   17   40    8 o 11.43042 4.112933   12.96991   341.5   1.503607 1.202886          ?        ? 
1 1 1   17   40    9 o 10.15736 4.047037   15.07491   198.8  0.9923807 1.232958          ?        ? 
1 1 1   17   41    0 o 9.968591 5.872060   17.30078   360.0   1.533679 1.954689   1.533679 1.954689 
1 1 1   17   41    1 o 10.80155 4.292050   12.67828   152.7  0.9623086 1.383319          ?        ? 
1 1 1   17   41    2 o 59.78198 1.609697   56.83884   201.0   36.47751 1.924617          ?        ? 
1 1 1   17   41    3 o 19.89172 3.919054   29.51982    99.2   4.570966 1.503607          ?        ? 
1 1 1   17   41    4 o 13.44227 4.529442   14.98738   180.9   2.135122 1.443463          ?        ? 
1 1 1   17   41    5 o 29.58180 2.592268   24.06528   277.1   9.292293 1.533679          ?        ? 
1 1 1   17   41    6 o 22.19131 2.642507   17.11838   242.0   5.292697 1.172814          ?        ? 
1 1 1   17   41    7 o 18.04890 3.709502   28.88600   102.8   3.879307 1.293102          ?        ? 
1 1 1   17   41    8 o 14.21454 4.106547   15.71553   342.5   2.556132 1.232958          ?        ? 
1 1 1   17   42    0 o 14.68293 6.806311   18.76778    -0.0   3.698874 2.195267   3.698874 2.195267 
1 1 1   17   42    1 o 12.29089 4.454768   13.64449   121.1   1.684040 1.413391          ?        ? 
1 1 1   17   42    2 f 15.05259 4.583403   15.40983   298.6   2.796710 1.503607          ?        ? 
1 1 1   17   42    3 o 15.00499 4.354564   15.45166   272.2   2.766637 1.383319          ?        ? 
1 1 1   17   42    4 o 22.91000 3.412814   32.00724   150.5   5.924213 1.563751          ?        ? 
1 1 1   17   42    5 o 14.02705 4.526924   5.299518   274.7   2.526060 1.443463          ?        ? 
1 1 1   17   42    6 o 24.04089 2.564293   25.08850     2.2   6.255006 1.232958          ?        ? 
1 1 1   17   43    0 o 20.07948 6.179453   18.05796     0.0   5.713707 2.165194   5.713707 2.165194 
1 1 1   17   43    1 o 9.777541 4.218508   10.90750   125.0  0.4811543 1.503607          ?        ? 
1 1 1   17   43    2 o 7.578144 3.579558   15.46801   133.9  -1.112669 1.443463          ?        ? 
1 1 1   17   43    3 o 13.73144 4.576375   15.96439   352.1   2.435844 1.473535          ?        ? 
1 1 1   17   43    4 o 11.20420 4.436800   8.192122   284.7   1.353247 1.473535          ?        ? 
1 1 1   18    0    0 f 13.76482 5.166457   40.93042     0.0   2.556132 1.323174   2.556132 1.323174 
1 1 1   18    0    1 o 229.9569 2.132011   187.9843     0.0   529.0593 9.803518   529.0593 9.803518 
1 1 1   18    0    2 o 206.8848 2.028167   204.8390     0.0   428.2274 8.390128   428.2274 8.390128 
1 1 1   18    0    3 o 339.7894 3.107014   407.5913     0.0   1155.462 21.11065   1155.462 21.11065 
1 1 1   18    0    4 o 275.1641 2.503162   349.7153     0.0   757.6376 13.77304   757.6376 13.77304 
1 1 1   18    0    5 o 56.23773 1.097133   91.42562   180.0   31.66597 1.232958   31.66597 1.232958 
1 1 1   18    0    6 o 156.8554 1.601228   168.0529     0.0   246.1706 5.022048   246.1706 5.022048 
1 1 1   18    0    7 o 6.555811 3.402630   34.97573   180.0  0.6315150 0.5713707  0.6315150 0.5713707 
1 1 1   18    0    8 o 3.513591 2.383795   86.55344   180.0 -0.2105050 0.4811543 -0.2105050 0.4811543 
1 1 1   18    0    9 o 18.30920 1.582961   67.89355     0.0   3.428224 0.5713707   3.428224 0.5713707 
1 1 1   18    0   10 o 3.266490 2.276734   5.497059   180.0 -0.4210100 0.5112265 -0.4210100 0.5112265 
1 1 1   18    0   11 o 12.75940 1.696977   10.59202   180.0   1.714112 0.4210100   1.714112 0.4210100 
1 1 1   18    0   12 o 22.51963 1.141291   36.37109   180.0   5.112265 0.5112265   5.112265 0.5112265 
1 1 1   18    0   13 o 29.71610 1.116614   52.17436   180.0   8.871283 0.6615872   8.871283 0.6615872 
1 1 1   18    0   14 o 25.03053 1.574676   35.91743   180.0   6.345222 0.7818757   6.345222 0.7818757 
1 1 1   18    0   15 o 18.47466 2.080177   3.962381   180.0   3.548513 0.7518036   3.548513 0.7518036 
1 1 1   18    0   16 o 57.85746 1.248725   85.16566     0.0   33.56051 1.443463   33.56051 1.443463 
1 1 1   18    0   17 o 9.140159 4.144606  0.1652144   180.0   1.232958 0.8119479   1.232958 0.8119479 
1 1 1   18    0   18 o 23.29105 2.300485   48.59690     0.0   5.623491 1.052525   5.623491 1.052525 
1 1 1   18    0   19 o 6.215129 3.959420   5.342646   180.0  0.2105050 1.052525  0.2105050 1.052525 
1 1 1   18    0   20 f 6.223722 3.962282   9.720030     0.0  0.2405772 1.052525  0.2405772 1.052525 
1 1 1   18    0   21 o 5.261789 3.616389   2.936675   180.0 -0.5412986 1.172814 -0.5412986 1.172814 
1 1 1   18    0   22 o 10.57787 4.786206   17.06950     0.0   1.804329 1.082597   1.804329 1.082597 
1 1 1   18    1    0 o 97.34275 1.328956   5.102275     0.0   94.81747 2.586205   94.81747 2.586205 
1 1 1   18    1    1 o 151.3073 1.142805   187.0600   267.3   228.9693 3.458297          ?        ? 
1 1 1   18    1    2 o 41.76183 0.8641044   27.28007   145.8   17.44184 0.7217315          ?        ? 
1 1 1   18    1    3 o 108.5546 0.9557301   127.3028   186.8   117.8527 2.074978          ?        ? 
1 1 1   18    1    4 o 281.9522 1.861163   347.6127   140.6   795.3180 10.49518          ?        ? 
1 1 1   18    1    5 o 268.9762 1.744115   303.6805   187.9   723.8365 9.382509          ?        ? 
1 1 1   18    1    6 o 93.04113 0.8403549   107.1354   142.7   86.57771 1.563751          ?        ? 
1 1 1   18    1    7 o 73.71130 0.7547482   112.2915   110.6   54.34037 1.112669          ?        ? 
1 1 1   18    1    8 o 151.9848 1.167391   180.1812   285.6   231.0744 3.548513          ?        ? 
1 1 1   18    1    9 o 49.86103 1.025303   87.94796   152.6   24.86966 1.022453          ?        ? 
1 1 1   18    1   10 o 37.26220 1.210562   28.08647   204.5   13.89333 0.9021643          ?        ? 
1 1 1   18    1   11 o 47.25484 1.113669   56.73713   203.5   22.34361 1.052525          ?        ? 
1 1 1   18    1   12 o 60.23413 0.8487322   58.07455   177.9   36.29708 1.022453          ?        ? 
1 1 1   18    1   13 f 53.29575 0.8745879   77.93950   289.9   28.41818 0.9322364          ?        ? 
1 1 1   18    1   14 o 62.89537 0.7411010   61.28025   336.7   39.57494 0.9322364          ?        ? 
1 1 1   18    1   15 o 66.85012 0.7872276   89.13522   196.6   44.71728 1.052525          ?        ? 
1 1 1   18    1   16 o 17.47113 1.807310   30.07897   262.5   3.067359 0.6315150          ?        ? 
1 1 1   18    1   17 o 30.08366 1.249522   45.00477    11.6   9.081788 0.7518036          ?        ? 
1 1 1   18    1   18 o 17.34178 1.820790   32.83820   179.5   3.037287 0.6315150          ?        ? 
1 1 1   18    1   19 o 31.54570 1.191610   35.67553     6.3   10.01402 0.7518036          ?        ? 
1 1 1   18    1   20 o 15.82543 2.280291   5.311882   296.6   2.586205 0.7217315          ?        ? 
1 1 1   18    1   21 o 8.603168 3.228847   10.01864    91.7  0.6615872 0.7518036          ?        ? 
1 1 1   18    1   22 o 16.79428 2.327804   14.66418   149.1   3.007215 0.7818757          ?        ? 
1 1 1   18    2    0 o 28.99312 1.565438   62.44877   180.0   8.480345 0.9021643   8.480345 0.9021643 
1 1 1   18    2    1 o 140.6703 1.079576   197.7002   151.1   197.9048 3.037287          ?        ? 
1 1 1   18    2    2 o 138.5706 1.063382   166.5924   188.0   192.0407 2.947070          ?        ? 
1 1 1   18    2    3 o 79.63499 0.8307745   84.85022   346.9   63.42215 1.323174          ?        ? 
1 1 1   18    2    4 o 122.3682 1.007581   103.6236   155.3   149.7593 2.465916          ?        ? 
1 1 1   18    2    5 o 130.9581 1.056307   143.3907   111.1   171.5315 2.766637          ?        ? 
1 1 1   18    2    6 o 105.8880 0.8945990   153.3133    78.9   112.1390 1.894545          ?        ? 
1 1 1   18    2    7 o 143.7163 1.056695   183.6930   176.9   206.5956 3.037287          ?        ? 
1 1 1   18    2    8 o 84.32296 0.9629025   126.0903   130.8   71.12062 1.623896          ?        ? 
1 1 1   18    2    9 o 60.01183 1.027263   93.86377    44.5   36.02643 1.232958          ?        ? 
1 1 1   18    2   10 o 50.72354 1.096798   93.35782   157.4   25.74175 1.112669          ?        ? 
1 1 1   18    2   11 o 73.41199 1.003607   110.1394   149.4   53.91936 1.473535          ?        ? 
1 1 1   18    2   12 o 59.90010 1.104484   42.71566    33.8   35.90614 1.323174          ?        ? 
1 1 1   18    2   13 f 25.47005 1.416824   28.46231   307.4   6.495584 0.7217315          ?        ? 
1 1 1   18    2   14 o 68.56786 1.140295   89.44887    95.5   47.06291 1.563751          ?        ? 
1 1 1   18    2   15 o 84.39196 0.8373966   113.3846   144.8   71.27098 1.413391          ?        ? 
1 1 1   18    2   16 o 22.37616 1.411134   18.14913   222.0   5.022048 0.6315150          ?        ? 
1 1 1   18    2   17 o 45.61049 0.8900890   67.21482    46.0   20.84000 0.8119479          ?        ? 
1 1 1   18    2   18 o 29.87534 1.157575   38.98418    72.7   8.961499 0.6916593          ?        ? 
1 1 1   18    2   19 o 20.44845 1.764758   24.60157   240.8   4.240172 0.7217315          ?        ? 
1 1 1   18    2   20 o 9.545279 3.202797   3.022253   137.7  0.9322364 0.7217315          ?        ? 
1 1 1   18    2   21 o 26.52504 1.417158   28.29486   346.5   7.157170 0.7518036          ?        ? 
1 1 1   18    2   22 o 17.40777 2.418518   17.62877    56.2   3.247792 0.8420200          ?        ? 
1 1 1   18    3    0 o 105.6347 1.409731   131.8255   180.0   111.6579 2.977142   111.6579 2.977142 
1 1 1   18    3    1 o 226.5461 1.572991   229.5230   125.4   513.3616 7.127099          ?        ? 
1 1 1   18    3    2 o 44.37991 0.8470089   113.8546   155.2   19.69725 0.7518036          ?        ? 
1 1 1   18    3    3 o 183.9716 1.324033   199.8981   227.6   338.5221 4.871688          ?        ? 
1 1 1   18    3    4 o 147.1735 1.164688   223.3561   200.1   216.6397 3.428224          ?        ? 
1 1 1   18    3    5 o 37.87112 0.9528784   73.24192   293.2   14.34441 0.7217315          ?        ? 
1 1 1   18    3    6 o 115.7207 1.078454   173.6859    28.1   133.9413 2.495988          ?        ? 
1 1 1   18    3    7 o 80.13659 1.013205   150.6460    22.7   64.23410 1.623896          ?        ? 
1 1 1   18    3    8 o 93.40502 1.030254   151.0170    49.9   87.26937 1.924617          ?        ? 
1 1 1   18    3    9 o 77.90812 0.9842873   63.06358   119.0   60.71566 1.533679          ?        ? 
1 1 1   18    3   10 o 69.86822 1.032990   65.87715    59.7   48.83716 1.443463          ?        ? 
1 1 1   18    3   11 o 40.65541 1.183494   65.20574    69.6   16.53968 0.9623086          ?        ? 
1 1 1   18    3   12 o 53.08787 1.217889   56.66467   309.1   28.20767 1.293102          ?        ? 
1 1 1   18    3   13 o 33.18756 1.766948   21.45471    20.3   11.03648 1.172814          ?        ? 
1 1 1   18    3   14 o 43.25720 1.251349   48.16507    48.5   18.73495 1.082597          ?        ? 
1 1 1   18    3   15 o 39.85076 1.282853   49.16972   300.0   15.90816 1.022453          ?        ? 
1 1 1   18    3   16 o 83.12193 0.8321021   93.32178   246.9   69.16593 1.383319          ?        ? 
1 1 1   18    3   17 o 74.48461 0.8680332   86.99146   330.9   55.57333 1.293102          ?        ? 
1 1 1   18    3   18 o 11.64138 3.151798   4.671780    69.4   1.443463 0.7518036          ?        ? 
1 1 1   18    3   19 o 30.87501 1.168796   38.20896   333.6   9.593014 0.7217315          ?        ? 
1 1 1   18    3   20 o 46.87854 0.9622360   58.58934   248.7   22.10303 0.9021643          ?        ? 
1 1 1   18    3   21 o 20.65728 2.038071   31.71237   264.0   4.420605 0.8420200          ?        ? 
1 1 1   18    3   22 o 20.89495 2.086849   21.59239   139.2   4.601038 0.8720922          ?        ? 
1 1 1   18    4    0 o 147.7984 1.709638   151.0874   180.0   218.5643 5.052120   218.5643 5.052120 
1 1 1   18    4    1 o 108.3331 0.9438044   85.24828   186.5   117.3716 2.044906          ?        ? 
1 1 1   18    4    2 o 236.8712 1.612337   304.6339   111.7   561.2365 7.638325          ?        ? 
1 1 1   18    4    3 o 184.5910 1.319590   208.0355    74.8   340.8076 4.871688          ?        ? 
1 1 1   18    4    4 o 194.9698 1.365024   181.1077   337.1   380.2322 5.322770          ?        ? 
1 1 1   18    4    5 o 61.08577 0.8615140   17.57872     3.9   37.31953 1.052525          ?        ? 
1 1 1   18    4    6 o 225.0949 1.629891   277.8210   148.4   506.9261 7.337603          ?        ? 
1 1 1   18    4    7 o 98.75500 1.096245   107.8209    58.0   97.55404 2.165194          ?        ? 
1 1 1   18    4    8 o 89.76055 1.038581   74.30874    43.0   80.59335 1.864473          ?        ? 
1 1 1   18    4    9 o 97.55692 1.063470   161.0623    80.9   95.20841 2.074978          ?        ? 
1 1 1   18    4   10 o 101.0309 1.131081   130.1049   188.6   102.1250 2.285483          ?        ? 
1 1 1   18    4   11 o 77.33379 1.166585   142.9765   115.5   59.84357 1.804329          ?        ? 
1 1 1   18    4   12 o 120.2765 1.525153   153.7427   187.0   144.8575 3.668802          ?        ? 
1 1 1   18    4   13 o 84.32800 1.212472   95.11263   248.7   71.18076 2.044906          ?        ? 
1 1 1   18    4   14 o 102.5873 1.377744   109.5811   260.2   105.4029 2.826782          ?        ? 
1 1 1   18    4   15 o 60.39343 1.269740   87.54475   266.0   36.53765 1.533679          ?        ? 
1 1 1   18    4   16 o 56.21530 1.150134   57.81891   210.3   31.66597 1.293102          ?        ? 
1 1 1   18    4   17 o 59.09451 0.8142116   75.66619   341.9   34.97390 0.9623086          ?        ? 
1 1 1   18    4   18 o 35.05556 1.029411   41.03989   255.2   12.32958 0.7217315          ?        ? 
1 1 1   18    4   19 o 22.55022 1.533598   28.01507   351.6   5.142337 0.6916593          ?        ? 
1 1 1   18    4   20 o 22.28088 1.687105   28.25974   115.5   5.052120 0.7518036          ?        ? 
1 1 1   18    4   21 o 18.69462 2.171608   20.60384    56.1   3.638730 0.8119479          ?        ? 
1 1 1   18    4   22 o 6.550117 2.922686   12.71517   200.3 -0.1503607 0.7818757          ?        ? 
1 1 1   18    5    0 o 333.8237 2.968792   412.8488   180.0   1115.165 19.81754   1115.165 19.81754 
1 1 1   18    5    1 o 333.4535 2.146377   365.3637    58.5   1112.459 14.31434          ?        ? 
1 1 1   18    5    2 o 45.01880 0.8683879   64.30330   227.8   20.26863 0.7818757          ?        ? 
1 1 1   18    5    3 o 196.3598 1.470222   244.5510   295.8   385.6753 5.773852          ?        ? 
1 1 1   18    5    4 o 89.43108 1.025595   58.96932   278.1   79.99191 1.834401          ?        ? 
1 1 1   18    5    5 o 146.6653 1.240488   182.3971    58.4   215.1662 3.638730          ?        ? 
1 1 1   18    5    6 o 99.92489 1.023221   134.1176   141.0   99.86959 2.044906          ?        ? 
1 1 1   18    5    7 o 78.41019 1.016337   128.3720   124.5   61.49754 1.593824          ?        ? 
1 1 1   18    5    8 o 108.7473 1.133783   135.4205   102.8   118.3038 2.465916          ?        ? 
1 1 1   18    5    9 f 117.1651 1.167825   144.0602   147.6   137.3395 2.736565          ?        ? 
1 1 1   18    5   10 o 191.9241 1.707896   259.4319   188.7   368.7747 6.555727          ?        ? 
1 1 1   18    5   11 o 74.64452 1.168327   74.53232   174.0   55.75375 1.744184          ?        ? 
1 1 1   18    5   12 o 151.0846 1.562478   182.4249   217.1   228.5784 4.721327          ?        ? 
1 1 1   18    5   13 o 20.40036 2.579673   38.04419   140.0   4.180028 1.052525          ?        ? 
1 1 1   18    5   14 o 18.57616 3.692642   13.06367   168.6   3.608657 1.323174          ?        ? 
1 1 1   18    5   15 o 26.66312 2.424890   37.95208   131.5   7.157170 1.293102          ?        ? 
1 1 1   18    5   16 f 34.38868 1.705232   37.70106   116.1   11.87850 1.172814          ?        ? 
1 1 1   18    5   17 o 54.16630 0.7772546   63.52686   154.8   29.38048 0.8420200          ?        ? 
1 1 1   18    5   18 o 40.39045 0.9306701   34.30099    62.0   16.35925 0.7518036          ?        ? 
1 1 1   18    5   19 o 14.82016 2.333508   14.76260   146.2   2.255411 0.6916593          ?        ? 
1 1 1   18    5   20 o 16.88935 2.314700   24.72328   141.8   2.947070 0.7818757          ?        ? 
1 1 1   18    5   21 o 24.22635 1.675754   34.13719   202.6   6.014429 0.8119479          ?        ? 
1 1 1   18    5   22 o 13.49979 3.074982   16.27979   264.3   2.105050 0.8119479          ?        ? 
1 1 1   18    6    0 o 54.35780 1.524019   140.5834   180.0   29.62106 1.653968   29.62106 1.653968 
1 1 1   18    6    1 o 126.8078 1.150165   113.2672   197.5   160.8258 2.916998          ?        ? 
1 1 1   18    6    2 o 153.5914 1.243287   197.6728   202.4   235.9460 3.819162          ?        ? 
1 1 1   18    6    3 o 93.28354 0.9510020   126.5983   149.9   87.02879 1.774257          ?        ? 
1 1 1   18    6    4 o 123.6227 1.118985   138.2446   160.7   152.8567 2.766637          ?        ? 
1 1 1   18    6    5 o 136.8151 1.153957   188.7391   188.1   187.2292 3.157575          ?        ? 
1 1 1   18    6    6 o 65.54916 0.8487289   47.60151    23.5   42.97309 1.112669          ?        ? 
1 1 1   18    6    7 o 53.72282 1.035565   98.06532   127.6   28.86926 1.112669          ?        ? 
1 1 1   18    6    8 f 110.8520 1.180076   138.1270    92.2   122.9349 2.616277          ?        ? 
1 1 1   18    6    9 f 27.07613 1.554912   56.41344   206.3   7.337603 0.8420200          ?        ? 
1 1 1   18    6   10 o 52.98505 1.078362   97.19934   298.9   28.08738 1.142741          ?        ? 
1 1 1   18    6   11 o 84.52270 1.085153   100.0130   152.4   71.48148 1.834401          ?        ? 
1 1 1   18    6   12 o 115.9786 1.283487   146.8745    57.1   134.6330 2.977142          ?        ? 
1 1 1   18    6   13 o 62.43391 1.444991   61.65185   322.6   39.03365 1.804329          ?        ? 
1 1 1   18    6   14 o 35.05174 2.016150   61.83239   344.7   12.32958 1.413391          ?        ? 
1 1 1   18    6   15 o 29.37781 2.405541   54.80589   184.4   8.690849 1.413391          ?        ? 
1 1 1   18    6   16 o 16.68583 3.178154   14.52987    82.9   2.916998 1.022453          ?        ? 
1 1 1   18    6   17 o 40.19200 1.496424   33.94986   272.3   16.23896 1.202886          ?        ? 
1 1 1   18    6   18 o 21.51270 1.467772   27.16719    60.5   4.661182 0.6315150          ?        ? 
1 1 1   18    6   19 o 22.87385 1.511900   26.81668    69.9   5.292697 0.6916593          ?        ? 
1 1 1   18    6   20 o 8.896670 3.246569   17.52675    91.8  0.7217315 0.7518036          ?        ? 
1 1 1   18    6   21 o 12.21276 3.172903   10.72129    18.3   1.684040 0.7818757          ?        ? 
1 1 1   18    6   22 o 20.32511 2.071379   26.93601   340.2   4.360461 0.8420200          ?        ? 
1 1 1   18    7    0 o 196.1734 2.369163   197.3415   180.0   385.1339 9.292293   385.1339 9.292293 
1 1 1   18    7    1 o 165.2773 1.464695   181.2060   244.5   273.2355 4.841615          ?        ? 
1 1 1   18    7    2 o 64.01793 1.009953   76.04349   215.6   40.98833 1.293102          ?        ? 
1 1 1   18    7    3 o 212.9872 1.779023   281.0130   137.9   453.8488 7.578181          ?        ? 
1 1 1   18    7    4 o 200.2515 1.636874   251.8562   164.6   401.1925 6.555727          ?        ? 
1 1 1   18    7    5 o 51.70069 0.9597364   42.19078   302.2   26.73414 0.9923807          ?        ? 
1 1 1   18    7    6 o 87.61356 0.8752523   93.20312    78.8   76.77419 1.533679          ?        ? 
1 1 1   18    7    7 o 39.15327 1.344109   85.34676    27.4   15.33679 1.052525          ?        ? 
1 1 1   18    7    8 o 86.35567 1.218826   124.0575   156.1   74.60899 2.105050          ?        ? 
1 1 1   18    7    9 o 109.5305 1.276681   152.5395   192.9   120.0480 2.796710          ?        ? 
1 1 1   18    7   10 o 52.26764 1.179466   75.25942    38.6   27.33558 1.232958          ?        ? 
1 1 1   18    7   11 o 95.90183 1.285646   125.3463    71.1   92.05083 2.465916          ?        ? 
1 1 1   18    7   12 o 47.93850 1.380075   74.67049   178.4   23.00519 1.323174          ?        ? 
1 1 1   18    7   13 o 59.25147 1.421096   49.69892   158.1   35.15434 1.684040          ?        ? 
1 1 1   18    7   14 o 40.98404 1.687631   44.56544    85.2   16.84040 1.383319          ?        ? 
1 1 1   18    7   15 o 81.58994 1.529593   83.51730   110.3   66.76016 2.495988          ?        ? 
1 1 1   18    7   16 o 26.11570 2.475718   27.57472   297.1   6.886521 1.293102          ?        ? 
1 1 1   18    7   17 o 32.84526 1.602248   35.15043   298.5   10.85604 1.052525          ?        ? 
1 1 1   18    7   18 o 27.96506 1.021580   32.54318   324.9   7.848830 0.5713707          ?        ? 
1 1 1   18    7   19 o 26.69404 1.295531   33.78392    53.9   7.187243 0.6916593          ?        ? 
1 1 1   18    7   20 o 23.33206 1.611096   27.75352    41.8   5.533275 0.7518036          ?        ? 
1 1 1   18    7   21 o 8.861626 3.245317   7.287821   176.0  0.7518036 0.7518036          ?        ? 
1 1 1   18    7   22 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   18    8    0 o 45.33551 1.562879   70.42553     0.0   20.62949 1.413391   20.62949 1.413391 
1 1 1   18    8    1 o 353.3805 2.557210   421.5339    26.6   1249.859 18.07336          ?        ? 
1 1 1   18    8    2 o 138.8533 1.342764   120.2916    49.7   192.8527 3.728946          ?        ? 
1 1 1   18    8    3 o 58.36689 0.9274069   96.43205   254.9   34.07174 1.082597          ?        ? 
1 1 1   18    8    4 o 225.0053 1.784238   256.4836   276.8   506.5653 8.029263          ?        ? 
1 1 1   18    8    5 o 323.2020 2.372633   404.2232   293.1   1045.699 15.33679          ?        ? 
1 1 1   18    8    6 o 139.2498 1.133781   127.5611    33.8   193.9653 3.157575          ?        ? 
1 1 1   18    8    7 f 76.42707 1.121404   108.7477   311.4   58.43018 1.714112          ?        ? 
1 1 1   18    8    8 o 56.23206 1.230009   84.12873   201.7   31.63589 1.383319          ?        ? 
1 1 1   18    8    9 o 137.2510 1.467992   189.9339   252.7   188.5524 4.029667          ?        ? 
1 1 1   18    8   10 o 20.71394 2.177674   53.48480    94.1   4.300317 0.9021643          ?        ? 
1 1 1   18    8   11 o 48.83978 1.323821   85.59280   109.3   23.87728 1.293102          ?        ? 
1 1 1   18    8   12 o 60.26709 1.322300   69.35957   226.4   36.35722 1.593824          ?        ? 
1 1 1   18    8   13 o 67.14387 1.343629   91.60844   255.4   45.13829 1.804329          ?        ? 
1 1 1   18    8   14 o 15.93050 4.048736   35.71820   331.4   2.676421 1.293102          ?        ? 
1 1 1   18    8   15 o 25.56456 2.529092   26.83569   211.1   6.585800 1.293102          ?        ? 
1 1 1   18    8   16 o 56.29747 1.655912   52.13548    33.1   31.84640 1.864473          ?        ? 
1 1 1   18    8   17 o 20.93038 3.376409   39.04737   215.8   4.510822 1.413391          ?        ? 
1 1 1   18    8   18 o 13.46655 1.786479   16.74277   311.4   1.834401 0.4811543          ?        ? 
1 1 1   18    8   19 o 14.64114 2.156645   19.31351   333.9   2.195267 0.6315150          ?        ? 
1 1 1   18    8   20 o 38.08882 1.065861   46.58815    80.4   14.61506 0.8119479          ?        ? 
1 1 1   18    8   21 o 30.20742 1.393731   37.65169    71.4   9.292293 0.8420200          ?        ? 
1 1 1   18    9    0 o 167.3607 2.022114   198.3475     0.0   280.3025 6.766232   280.3025 6.766232 
1 1 1   18    9    1 o 174.2413 1.467007   235.6379   259.0   303.6986 5.112265          ?        ? 
1 1 1   18    9    2 f 196.5662 1.621666   173.0453   268.0   386.5474 6.375295          ?        ? 
1 1 1   18    9    3 o 78.24017 1.037763   106.6068    26.1   61.22689 1.623896          ?        ? 
1 1 1   18    9    4 o 115.7439 1.195155   142.8771    56.7   134.0015 2.766637          ?        ? 
1 1 1   18    9    5 o 171.5421 1.349847   206.7060    18.4   294.3762 4.631110          ?        ? 
1 1 1   18    9    6 o 127.3541 1.086198   161.9016   309.1   162.2392 2.766637          ?        ? 
1 1 1   18    9    7 o 50.24899 1.226848   112.3073   354.0   25.26060 1.232958          ?        ? 
1 1 1   18    9    8 o 48.88252 1.261144   46.19078   112.0   23.90735 1.232958          ?        ? 
1 1 1   18    9    9 o 170.1587 1.652426   241.3763   126.6   289.8654 5.623491          ?        ? 
1 1 1   18    9   10 o 8.934101 3.490113   2.366532     8.3  0.4811543 0.9021643          ?        ? 
1 1 1   18    9   11 f 102.0451 1.252452   106.1290   202.6   104.2301 2.556132          ?        ? 
1 1 1   18    9   12 o 99.44209 1.360839   127.1754   214.8   98.99751 2.706493          ?        ? 
1 1 1   18    9   13 o 71.66399 1.342806   77.87621   140.1   51.42337 1.924617          ?        ? 
1 1 1   18    9   14 o 60.61745 1.339462   69.79610   276.4   36.80830 1.623896          ?        ? 
1 1 1   18    9   15 o 25.86073 2.441985   30.16025   238.0   6.736160 1.263030          ?        ? 
1 1 1   18    9   16 o 60.28264 1.371844   73.56567   249.7   36.47751 1.653968          ?        ? 
1 1 1   18    9   17 o 19.37266 3.862375   9.540540   251.6   4.029667 1.443463          ?        ? 
1 1 1   18    9   18 o 51.09209 1.765761   57.11599   227.6   26.40334 1.804329          ?        ? 
1 1 1   18    9   19 o 6.261490 2.647215   9.987695    20.0       0.06 0.5713707          ?        ? 
1 1 1   18    9   20 o 23.73272 1.457185   27.70572    21.7   5.713707 0.6916593          ?        ? 
1 1 1   18    9   21 o 8.791015 3.294087   11.86625   196.5  0.7217315 0.7818757          ?        ? 
1 1 1   18   10    0 o 98.67715 1.555104   158.1968   180.0   97.46382 3.067359   97.46382 3.067359 
1 1 1   18   10    1 o 149.2813 1.420196   201.1582   255.9   222.9248 4.240172          ?        ? 
1 1 1   18   10    2 o 94.62308 1.112334   76.29282   202.6   89.55484 2.105050          ?        ? 
1 1 1   18   10    3 o 121.3602 1.226573   153.4624   288.1   147.3234 2.977142          ?        ? 
1 1 1   18   10    4 o 148.7567 1.344341   163.8853   215.9   221.3611 3.999595          ?        ? 
1 1 1   18   10    5 o 196.9685 1.503848   229.5458   102.3   388.1713 5.924213          ?        ? 
1 1 1   18   10    6 o 108.2832 0.9858974   142.1152   221.1   117.2814 2.135122          ?        ? 
1 1 1   18   10    7 o 91.46883 0.9698694   103.3030    61.4   83.69077 1.774257          ?        ? 
1 1 1   18   10    8 o 71.96554 1.128246   92.71019    51.7   51.81431 1.623896          ?        ? 
1 1 1   18   10    9 o 209.5743 1.886914   260.5406   160.7   439.8352 7.908974          ?        ? 
1 1 1   18   10   10 f 101.7483 1.211773   154.2053   236.1   103.5985 2.465916          ?        ? 
1 1 1   18   10   11 o 31.09360 1.644154   46.71658   216.1   9.683230 1.022453          ?        ? 
1 1 1   18   10   12 o 49.83582 1.448218   60.79175   160.0   24.86966 1.443463          ?        ? 
1 1 1   18   10   13 o 50.33506 1.523470   47.51566   107.7   25.38089 1.533679          ?        ? 
1 1 1   18   10   14 o 62.31878 1.423533   72.66248   182.5   38.91335 1.774257          ?        ? 
1 1 1   18   10   15 o 55.89867 1.452535   70.71708   120.2   31.33517 1.623896          ?        ? 
1 1 1   18   10   16 o 11.86820 4.264982   12.06798   284.2   1.263030 1.293102          ?        ? 
1 1 1   18   10   17 o 42.25887 1.565559   31.08015   151.5   17.98314 1.323174          ?        ? 
1 1 1   18   10   18 o 13.33483 4.227654   13.79688    24.6   1.894545 1.263030          ?        ? 
1 1 1   18   10   19 o 6.278859 2.611072   15.29887   262.2  0.1202886 0.5412986          ?        ? 
1 1 1   18   10   20 o 5.808668 2.608314   7.529102    56.9 -0.2405772 0.6315150          ?        ? 
1 1 1   18   10   21 o 13.93409 2.578906   15.78015   120.2   2.135122 0.6916593          ?        ? 
1 1 1   18   11    0 o 90.22937 1.484018   105.8207     0.0   81.49551 2.676421   81.49551 2.676421 
1 1 1   18   11    1 o 165.9279 1.486137   142.5623    26.3   275.4308 4.931832          ?        ? 
1 1 1   18   11    2 o 92.82684 1.085265   81.51808   223.3   86.18677 2.014834          ?        ? 
1 1 1   18   11    3 o 130.0859 1.294560   99.00044   193.7   169.2761 3.368080          ?        ? 
1 1 1   18   11    4 o 129.4279 1.138499   173.2927   236.8   167.5620 2.947070          ?        ? 
1 1 1   18   11    5 o 82.37594 0.9309025   54.03619   208.5   67.87283 1.533679          ?        ? 
1 1 1   18   11    6 o 71.02866 0.8679300   95.68356   175.8   50.46106 1.232958          ?        ? 
1 1 1   18   11    7 o 59.94019 0.8278092   65.37428   160.3   35.93621 0.9923807          ?        ? 
1 1 1   18   11    8 o 59.50119 1.187700   75.92518   180.0   35.42499 1.413391          ?        ? 
1 1 1   18   11    9 o 18.40132 2.859918   75.53554   337.0   3.398152 1.052525          ?        ? 
1 1 1   18   11   10 f 98.16603 1.255992   124.9223   344.5   96.44137 2.465916          ?        ? 
1 1 1   18   11   11 o 18.63839 2.742868   21.45140    11.3   3.488369 1.022453          ?        ? 
1 1 1   18   11   12 o 125.2631 1.452435   151.7956    39.3   157.1270 3.638730          ?        ? 
1 1 1   18   11   13 o 110.6922 1.602875   131.3314   256.2   122.7846 3.548513          ?        ? 
1 1 1   18   11   14 o 9.930203 4.102946   12.26377     6.8  0.3007214 1.323174          ?        ? 
1 1 1   18   11   15 o 37.12710 1.943948   62.56651   325.0   13.86326 1.443463          ?        ? 
1 1 1   18   11   16 o 21.71188 3.047121   31.17120   184.1   4.811543 1.323174          ?        ? 
1 1 1   18   11   17 o 22.57959 2.996615   24.15736   177.1   5.232553 1.353247          ?        ? 
1 1 1   18   11   18 o 19.57903 3.668250   22.19483   209.4   4.149956 1.383319          ?        ? 
1 1 1   18   11   19 o 5.623089 2.477954   18.50907   274.5 -0.1202886 0.5412986          ?        ? 
1 1 1   18   11   20 o 28.17207 1.227562   24.30248   304.3   8.029263 0.6916593          ?        ? 
1 1 1   18   11   21 o 30.77881 1.807525   34.43354    96.8   9.833591 1.112669          ?        ? 
1 1 1   18   12    0 o 151.5190 1.985476   284.0286   180.0   229.7813 6.014429   229.7813 6.014429 
1 1 1   18   12    1 o 104.2225 1.168579   170.8689   288.0   108.6507 2.435844          ?        ? 
1 1 1   18   12    2 f 102.0222 1.120092   110.0603   352.0   104.1098 2.285483          ?        ? 
1 1 1   18   12    3 o 61.91323 1.092857   54.67225   310.6   38.34198 1.353247          ?        ? 
1 1 1   18   12    4 o 76.03674 0.9491879   81.05560   129.5   57.82874 1.443463          ?        ? 
1 1 1   18   12    5 o 51.34954 0.9077359   74.71096   208.4   26.37327 0.9322364          ?        ? 
1 1 1   18   12    6 o 133.3437 1.127618   168.3573   148.9   177.8767 3.007215          ?        ? 
1 1 1   18   12    7 o 175.8813 1.359289   194.8127   133.2   309.5326 4.781471          ?        ? 
1 1 1   18   12    8 o 83.36698 0.9559082   113.6125    90.3   69.52679 1.593824          ?        ? 
1 1 1   18   12    9 o 110.7790 1.262292   108.6698    45.0   122.8146 2.796710          ?        ? 
1 1 1   18   12   10 o 51.53381 1.312970   92.43077    38.8   26.58378 1.353247          ?        ? 
1 1 1   18   12   11 o 126.0888 1.454848   158.4479   358.2   159.1719 3.668802          ?        ? 
1 1 1   18   12   12 o 74.37272 1.475855   57.34892   151.4   55.39289 2.195267          ?        ? 
1 1 1   18   12   13 o 77.39223 1.359988   103.9453   117.7   59.99393 2.105050          ?        ? 
1 1 1   18   12   14 o 85.99124 1.311419   98.15499   294.2   74.09776 2.255411          ?        ? 
1 1 1   18   12   15 o 57.93134 1.531344   63.90034    20.7   33.68080 1.774257          ?        ? 
1 1 1   18   12   16 f 22.98594 2.878225   19.90411   102.3   5.382914 1.323174          ?        ? 
1 1 1   18   12   17 o 44.65060 1.717423   39.12762    37.0   20.11827 1.533679          ?        ? 
1 1 1   18   12   18 o 11.62743 4.256391   12.79888   253.8   1.263030 1.293102          ?        ? 
1 1 1   18   12   19 o 18.51753 2.354775   17.76870   292.6   3.548513 0.8720922          ?        ? 
1 1 1   18   12   20 o 7.930838 3.307148   8.467570   271.1  0.2706493 0.8720922          ?        ? 
1 1 1   18   12   21 o 6.402651 3.039530   8.213148   181.2 -0.9923807 1.052525          ?        ? 
1 1 1   18   13    0 o 113.6424 1.773927   155.4930   180.0   129.2802 4.029667   129.2802 4.029667 
1 1 1   18   13    1 o 83.66067 1.096334   122.6266   345.7   70.00796 1.834401          ?        ? 
1 1 1   18   13    2 f 264.0176 2.073017   363.1400    19.9   697.7039 10.94626          ?        ? 
1 1 1   18   13    3 f 149.6398 1.256023   188.9039    39.0   224.0074 3.759018          ?        ? 
1 1 1   18   13    4 o 142.8365 1.221106   176.7972   300.6   204.0997 3.488369          ?        ? 
1 1 1   18   13    5 o 48.01995 0.9706762   86.16358   297.3   23.06533 0.9322364          ?        ? 
1 1 1   18   13    6 o 58.82567 0.8690534   82.65593     7.3   34.61304 1.022453          ?        ? 
1 1 1   18   13    7 o 137.6259 1.179935   211.9857    16.4   189.5147 3.247792          ?        ? 
1 1 1   18   13    8 o 59.68769 0.8061200   108.3421    28.1   35.63549 0.9623086          ?        ? 
1 1 1   18   13    9 o 22.71260 2.383253   14.08931   194.1   5.172409 1.082597          ?        ? 
1 1 1   18   13   10 o 54.31729 1.245687   95.62608   244.7   29.53085 1.353247          ?        ? 
1 1 1   18   13   11 o 86.20995 1.308092   94.48079    33.9   74.39848 2.255411          ?        ? 
1 1 1   18   13   12 o 62.52449 1.490994   102.3085    63.4   39.15393 1.864473          ?        ? 
1 1 1   18   13   13 o 48.48857 1.705524   47.07431   122.3   23.57656 1.653968          ?        ? 
1 1 1   18   13   14 o 15.25065 4.393815   27.92673   346.9   2.435844 1.413391          ?        ? 
1 1 1   18   13   15 o 42.35216 1.917135   47.89520   315.1   18.04329 1.623896          ?        ? 
1 1 1   18   13   16 o 10.43160 4.206712   14.45717   285.0  0.5713707 1.353247          ?        ? 
1 1 1   18   13   17 o 8.768353 3.867773   5.793955   233.3 -0.2706493 1.323174          ?        ? 
1 1 1   18   13   18 o 20.53185 1.611124   26.42297   334.3   4.270245 0.6615872          ?        ? 
1 1 1   18   13   19 o 21.08319 2.139535   29.32016   309.9   4.570966 0.9021643          ?        ? 
1 1 1   18   13   20 o 9.347302 3.433414   8.704876    71.6  0.8420200 0.8420200          ?        ? 
1 1 1   18   13   21 o 23.60524 2.165733   19.44916   349.7   5.894140 1.022453          ?        ? 
1 1 1   18   14    0 o 76.42204 1.536037   79.20112   180.0   58.49032 2.345627   58.49032 2.345627 
1 1 1   18   14    1 o 43.76071 1.133872   72.93269   241.1   19.15596 0.9923807          ?        ? 
1 1 1   18   14    2 o 101.1464 1.070327   131.5068    23.0   102.3355 2.165194          ?        ? 
1 1 1   18   14    3 o 172.5615 1.411580   230.7487   112.7   297.9247 4.871688          ?        ? 
1 1 1   18   14    4 o 88.37801 0.9867751   135.0126   133.6   78.12743 1.744184          ?        ? 
1 1 1   18   14    5 o 104.3306 1.095308   98.86668   321.8   108.8912 2.285483          ?        ? 
1 1 1   18   14    6 o 166.6159 1.335610   204.6964   316.7   277.7764 4.450677          ?        ? 
1 1 1   18   14    7 o 33.79637 1.067765   27.73891   264.0   11.42741 0.7217315          ?        ? 
1 1 1   18   14    8 o 43.13708 0.8714122   90.88759   327.5   18.61466 0.7518036          ?        ? 
1 1 1   18   14    9 o 101.8489 0.9448398   138.2012   281.9   103.7790 1.924617          ?        ? 
1 1 1   18   14   10 o 86.80972 1.212451   122.0021   204.2   75.42094 2.105050          ?        ? 
1 1 1   18   14   11 o 35.46972 1.526087   34.81641   236.4   12.60023 1.082597          ?        ? 
1 1 1   18   14   12 o 79.19300 1.253117   112.2954    39.7   62.79064 1.984761          ?        ? 
1 1 1   18   14   13 o 21.06710 3.140381   49.29282   341.5   4.480750 1.323174          ?        ? 
1 1 1   18   14   14 o 77.99536 1.426584   79.29502    87.3   60.98631 2.225339          ?        ? 
1 1 1   18   14   15 o 22.64773 3.186772   37.17116   119.9   5.232553 1.443463          ?        ? 
1 1 1   18   14   16 o 21.83555 3.236445   29.38817   107.4   4.901759 1.413391          ?        ? 
1 1 1   18   14   17 o 6.977102 3.332111   11.17096   321.0  -1.593824 1.293102          ?        ? 
1 1 1   18   14   18 o 10.83325 3.145844   6.100030   143.9   1.263030 0.7217315          ?        ? 
1 1 1   18   14   19 o 29.37800 1.484261   33.09275   177.5   8.750995 0.8720922          ?        ? 
1 1 1   18   14   20 o 25.52366 1.944041   27.94460   344.6   6.736160 0.9923807          ?        ? 
1 1 1   18   14   21 o 22.77185 2.377051   29.01359   253.5   5.563347 1.082597          ?        ? 
1 1 1   18   15    0 o 68.34426 1.519705   120.5761     0.0   46.79226 2.074978   46.79226 2.074978 
1 1 1   18   15    1 o 9.928047 3.397080   54.83220     6.1  0.9021643 0.8119479          ?        ? 
1 1 1   18   15    2 o 99.14725 1.167735   90.92291   138.4   98.33591 2.315555          ?        ? 
1 1 1   18   15    3 o 65.70326 1.098471   90.21946    34.3   43.18360 1.443463          ?        ? 
1 1 1   18   15    4 o 77.59457 1.143287   58.38614    96.9   60.23451 1.774257          ?        ? 
1 1 1   18   15    5 o 11.64033 3.403613   50.96855    37.5   1.383319 0.8420200          ?        ? 
1 1 1   18   15    6 o 163.4849 1.489950   220.3862    98.9   267.5218 4.871688          ?        ? 
1 1 1   18   15    7 o 118.1254 1.260162   121.3902   123.2   139.6250 2.977142          ?        ? 
1 1 1   18   15    8 o 56.25721 1.069095   86.94704   301.5   31.66597 1.202886          ?        ? 
1 1 1   18   15    9 o 53.82086 1.145428   55.68361    39.1   28.98955 1.232958          ?        ? 
1 1 1   18   15   10 f 126.9764 1.231529   169.4194    30.4   161.3671 3.127503          ?        ? 
1 1 1   18   15   11 o 87.02177 1.295889   101.0547   263.7   75.81188 2.255411          ?        ? 
1 1 1   18   15   12 o 51.39621 1.462761   71.41050   154.3   26.46349 1.503607          ?        ? 
1 1 1   18   15   13 o 30.55044 2.214774   23.54060   296.9   9.382509 1.353247          ?        ? 
1 1 1   18   15   14 o 7.684930 3.605963   9.648976   262.1  -1.443463 1.413391          ?        ? 
1 1 1   18   15   15 o 8.826180 3.916016   16.27008   240.4 -0.4210100 1.383319          ?        ? 
1 1 1   18   15   16 o 33.70825 2.185719   64.17306   324.1   11.51763 1.473535          ?        ? 
1 1 1   18   15   17 o 55.31300 0.9786101   60.46741   269.2   30.70366 1.082597          ?        ? 
1 1 1   18   15   18 o 14.11217 2.762168   17.56948   136.1   2.135122 0.7518036          ?        ? 
1 1 1   18   15   19 o 19.59925 2.224811   20.61095    95.9   3.969523 0.8720922          ?        ? 
1 1 1   18   15   20 o 9.140822 3.634322   5.194992   246.5  0.6615872 0.9923807          ?        ? 
1 1 1   18   16    0 o 41.82252 2.793702   25.08968     0.0   17.74257 2.315555   17.74257 2.315555 
1 1 1   18   16    1 o 54.44267 1.159963   80.08558    16.5   29.65113 1.263030          ?        ? 
1 1 1   18   16    2 o 31.96356 1.599404   18.14181    12.1   10.22453 1.022453          ?        ? 
1 1 1   18   16    3 o 153.2022 1.423107   206.8585    40.2   234.8634 4.360461          ?        ? 
1 1 1   18   16    4 o 138.1723 1.469086   191.0085    92.1   191.0483 4.059740          ?        ? 
1 1 1   18   16    5 o 157.2336 1.472684   180.7869   104.7   247.4336 4.631110          ?        ? 
1 1 1   18   16    6 o 180.1776 1.560541   212.3398    66.7   324.9596 5.623491          ?        ? 
1 1 1   18   16    7 o 52.89616 1.137026   81.57818   247.8   27.99717 1.202886          ?        ? 
1 1 1   18   16    8 o 75.20924 1.059593   126.7567    89.1   56.59578 1.593824          ?        ? 
1 1 1   18   16    9 o 68.05254 1.060550   81.57277   292.5   46.34118 1.443463          ?        ? 
1 1 1   18   16   10 o 107.5912 1.229816   122.1658    85.7   115.8680 2.646349          ?        ? 
1 1 1   18   16   11 o 116.5335 1.148348   146.8919    67.0   135.9261 2.676421          ?        ? 
1 1 1   18   16   12 o 68.76935 1.268141   58.40357   298.5   47.36363 1.744184          ?        ? 
1 1 1   18   16   13 o 25.71404 2.806761   15.00138    31.1   6.676016 1.443463          ?        ? 
1 1 1   18   16   14 o 74.96365 1.363932   77.04521    58.1   56.35520 2.044906          ?        ? 
1 1 1   18   16   15 o 9.466632 3.879686   4.180585   340.2  0.3608657 1.172814          ?        ? 
1 1 1   18   16   16 o 26.05878 1.327114   31.54580   162.6   6.826377 0.6916593          ?        ? 
1 1 1   18   16   17 o 5.785708 2.645631   4.053383   202.6 -0.4510822 0.6916593          ?        ? 
1 1 1   18   16   18 o 37.58358 1.240218   44.39445   325.3   14.25420 0.9322364          ?        ? 
1 1 1   18   16   19 o 19.94578 2.412312   22.93901   335.1   4.149956 0.9623086          ?        ? 
1 1 1   18   16   20 o 9.061357 3.623795   13.10982    32.0  0.6615872 0.9923807          ?        ? 
1 1 1   18   17    0 o 108.3971 1.707115   37.38856   180.0   117.6422 3.698874   117.6422 3.698874 
1 1 1   18   17    1 o 85.12623 1.289419   115.2221   298.9   72.50394 2.195267          ?        ? 
1 1 1   18   17    2 o 84.16714 1.304111   93.98057   257.7   70.88004 2.195267          ?        ? 
1 1 1   18   17    3 o 78.13564 1.116126   87.90086   161.1   61.07653 1.744184          ?        ? 
1 1 1   18   17    4 o 111.8008 1.250755   169.0422   152.1   125.0700 2.796710          ?        ? 
1 1 1   18   17    5 o 87.32097 1.170913   99.90633   218.8   76.29303 2.044906          ?        ? 
1 1 1   18   17    6 o 96.10543 1.110823   85.99879   270.2   92.41170 2.135122          ?        ? 
1 1 1   18   17    7 o 180.4933 1.582804   189.8287   288.6   326.1625 5.713707          ?        ? 
1 1 1   18   17    8 o 25.93070 1.739568   30.11119   213.4   6.736160 0.9021643          ?        ? 
1 1 1   18   17    9 f 74.03899 1.056032   91.23856   270.3   54.85159 1.563751          ?        ? 
1 1 1   18   17   10 o 112.5703 1.215492   146.2435   289.1   126.8443 2.736565          ?        ? 
1 1 1   18   17   11 o 30.25907 1.490734   38.30632   143.0   9.172004 0.9021643          ?        ? 
1 1 1   18   17   12 o 77.60994 1.026817   87.99574   232.8   60.29465 1.593824          ?        ? 
1 1 1   18   17   13 o 59.53282 1.010271   63.46470    40.3   35.48513 1.202886          ?        ? 
1 1 1   18   17   14 o 12.51374 3.031541   11.87426   207.0   1.653968 0.7518036          ?        ? 
1 1 1   18   17   15 o 46.14229 1.075348   61.63366   130.3   21.35122 0.9923807          ?        ? 
1 1 1   18   17   16 o 41.24246 1.130190   45.08410   202.4   17.08098 0.9322364          ?        ? 
1 1 1   18   17   17 o 41.55748 1.157804   44.33432   202.7   17.38170 0.9623086          ?        ? 
1 1 1   18   17   18 o 22.79280 1.979055   27.26072   317.9   5.322770 0.9021643          ?        ? 
1 1 1   18   17   19 o 26.06993 1.787954   27.72001   267.2   6.976738 0.9322364          ?        ? 
1 1 1   18   17   20 o 20.78745 2.459303   15.46260    86.9   4.631110 1.022453          ?        ? 
1 1 1   18   18    0 o 6.156308 4.079265   24.20837   360.0 -0.2105050 1.263030 -0.2105050 1.263030 
1 1 1   18   18    1 o 96.82052 1.304507   115.9190   223.5   93.79502 2.526060          ?        ? 
1 1 1   18   18    2 o 116.3655 1.408435   131.2688    30.5   135.5051 3.277864          ?        ? 
1 1 1   18   18    3 o 79.66757 1.283399   76.62039   211.0   63.51237 2.044906          ?        ? 
1 1 1   18   18    4 o 121.0998 1.465120   164.0965   256.2   146.7821 3.548513          ?        ? 
1 1 1   18   18    5 o 143.5282 1.414266   178.8417   178.6   206.1746 4.059740          ?        ? 
1 1 1   18   18    6 f 129.0866 1.351174   157.7110   181.1   166.7801 3.488369          ?        ? 
1 1 1   18   18    7 o 88.06929 1.143891   97.00454   146.1   77.61621 2.014834          ?        ? 
1 1 1   18   18    8 o 59.97637 1.103080   101.1710   203.0   35.99636 1.323174          ?        ? 
1 1 1   18   18    9 o 19.35142 2.486403   20.42819   269.4   3.759018 0.9623086          ?        ? 
1 1 1   18   18   10 o 70.68606 1.148668   76.98341    38.5   50.00998 1.623896          ?        ? 
1 1 1   18   18   11 o 26.43166 1.820372   22.52572    57.1   7.006810 0.9623086          ?        ? 
1 1 1   18   18   12 o 67.63480 1.044870   87.58043   208.8   45.79988 1.413391          ?        ? 
1 1 1   18   18   13 o 86.12115 1.134849   111.0571   256.2   74.30827 1.954689          ?        ? 
1 1 1   18   18   14 o 25.32934 1.187246   22.40249   278.4   6.435439 0.6014429          ?        ? 
1 1 1   18   18   15 o 12.29720 2.532117   11.79886   234.9   1.593824 0.6014429          ?        ? 
1 1 1   18   18   16 o 7.750920 2.945921   8.323635     8.9  0.4510822 0.6315150          ?        ? 
1 1 1   18   18   17 o 15.81528 2.566973   22.22781   216.2   2.586205 0.8119479          ?        ? 
1 1 1   18   18   18 o 11.30081 3.572020   10.71367   259.2   1.383319 0.9021643          ?        ? 
1 1 1   18   18   19 o 25.38199 1.895652   24.66302    12.3   6.645944 0.9623086          ?        ? 
1 1 1   18   18   20 o 7.733812 3.356233   8.430755     1.9  0.1202886 0.9623086          ?        ? 
1 1 1   18   19    0 o 95.07257 1.804402   56.56419   180.0   90.54723 3.428224   90.54723 3.428224 
1 1 1   18   19    1 o 181.6847 1.622080   201.8450   318.9   330.4628 5.894140          ?        ? 
1 1 1   18   19    2 o 92.81384 1.409422   73.57541   228.5   86.21684 2.616277          ?        ? 
1 1 1   18   19    3 o 111.7749 1.439375   127.5603   108.8   125.0400 3.217719          ?        ? 
1 1 1   18   19    4 o 30.99767 1.891777   53.75097   296.7   9.623086 1.172814          ?        ? 
1 1 1   18   19    5 o 66.46179 1.266924   90.85908    60.3   44.20605 1.684040          ?        ? 
1 1 1   18   19    6 o 157.0596 1.503037   193.1099   259.9   246.9525 4.721327          ?        ? 
1 1 1   18   19    7 o 32.64542 1.704174   42.67128   122.8   10.67561 1.112669          ?        ? 
1 1 1   18   19    8 o 45.92533 1.276870   42.21356   137.3   21.11065 1.172814          ?        ? 
1 1 1   18   19    9 f 85.76559 1.104490   75.73741   273.2   73.61661 1.894545          ?        ? 
1 1 1   18   19   10 o 114.4927 1.221349   118.9760   304.0   131.2348 2.796710          ?        ? 
1 1 1   18   19   11 o 78.48204 1.187834   79.06369   193.7   61.67797 1.864473          ?        ? 
1 1 1   18   19   12 o 22.14807 2.104555   37.87316   177.9   4.931832 0.9322364          ?        ? 
1 1 1   18   19   13 o 39.81573 1.019632   50.84367   343.9   15.87809 0.8119479          ?        ? 
1 1 1   18   19   14 o 32.21136 1.120306   36.70218   346.9   10.40496 0.7217315          ?        ? 
1 1 1   18   19   15 o 10.78416 2.874768   14.76831    15.8   1.232958 0.6315150          ?        ? 
1 1 1   18   19   16 o 37.51267 1.082232   45.80273    99.7   14.13391 0.8119479          ?        ? 
1 1 1   18   19   17 o 8.605480 3.054818   5.990900   309.3  0.6916593 0.6615872          ?        ? 
1 1 1   18   19   18 o 10.74961 3.520652   12.68765   266.3   1.232958 0.8720922          ?        ? 
1 1 1   18   19   19 o 12.76957 3.682595   11.70464   126.4   1.894545 0.9923807          ?        ? 
1 1 1   18   19   20 o 7.777766 3.417046   10.73391    11.5       0.06 1.022453          ?        ? 
1 1 1   18   20    0 o 92.73361 1.671282   115.1735    -0.0   86.12662 3.097431   86.12662 3.097431 
1 1 1   18   20    1 o 57.60266 1.200742   64.12395    38.0   33.19965 1.383319          ?        ? 
1 1 1   18   20    2 o 213.2374 1.826294   256.1769    38.5   455.3223 7.788685          ?        ? 
1 1 1   18   20    3 o 71.51527 1.282524   93.31373   113.9   51.18279 1.834401          ?        ? 
1 1 1   18   20    4 o 64.88215 1.297768   42.69839   327.8   42.13108 1.684040          ?        ? 
1 1 1   18   20    5 o 52.39967 1.463444   71.53640   299.2   27.48594 1.533679          ?        ? 
1 1 1   18   20    6 o 49.74755 1.450788   39.74738   107.5   24.77945 1.443463          ?        ? 
1 1 1   18   20    7 o 136.0196 1.403902   156.7372   304.1   185.2143 3.819162          ?        ? 
1 1 1   18   20    8 o 84.18847 1.178761   107.2183   121.9   70.94019 1.984761          ?        ? 
1 1 1   18   20    9 o 19.02834 2.686659   26.58399   295.6   3.638730 1.022453          ?        ? 
1 1 1   18   20   10 o 34.50879 1.699297   27.46897   265.9   11.93864 1.172814          ?        ? 
1 1 1   18   20   11 o 35.15571 1.539717   56.47063     0.2   12.38972 1.082597          ?        ? 
1 1 1   18   20   12 o 46.99594 1.279776   66.38481   293.1   22.13310 1.202886          ?        ? 
1 1 1   18   20   13 o 18.29115 1.890695   25.92245   108.0   3.368080 0.6916593          ?        ? 
1 1 1   18   20   14 o 13.53478 2.649600   8.349446    97.4   1.924617 0.6916593          ?        ? 
1 1 1   18   20   15 o 13.61241 2.634574   13.30028    31.5   1.954689 0.6916593          ?        ? 
1 1 1   18   20   16 o 31.67834 1.234086   31.63929   215.2   10.10424 0.7818757          ?        ? 
1 1 1   18   20   17 o 17.54142 2.057221   20.42950   145.8   3.157575 0.7217315          ?        ? 
1 1 1   18   20   18 o 9.784832 3.333580   11.34159    91.6  0.9923807 0.7818757          ?        ? 
1 1 1   18   20   19 o 12.51138 3.839837   15.41430    45.4   1.864473 1.052525          ?        ? 
1 1 1   18   21    0 o 39.96607 2.081156   93.35818   180.0   16.11867 1.653968   16.11867 1.653968 
1 1 1   18   21    1 o 101.4506 1.230149   135.8015   202.1   102.9971 2.495988          ?        ? 
1 1 1   18   21    2 o 119.2512 1.336527   118.4232    52.1   142.3315 3.187647          ?        ? 
1 1 1   18   21    3 o 37.05293 1.460880   39.92433   286.6   13.74297 1.082597          ?        ? 
1 1 1   18   21    4 o 69.31377 1.301566   53.43215   300.8   48.08536 1.804329          ?        ? 
1 1 1   18   21    5 o 198.1005 1.927891   266.6421    45.3   393.3136 7.638325          ?        ? 
1 1 1   18   21    6 f 85.14096 1.359836   91.18132    82.3   72.56409 2.315555          ?        ? 
1 1 1   18   21    7 o 78.54875 1.359106   81.06448    22.1   61.76818 2.135122          ?        ? 
1 1 1   18   21    8 o 85.91511 1.225076   93.36859   294.4   73.88726 2.105050          ?        ? 
1 1 1   18   21    9 o 32.03186 1.736817   31.70207     5.3   10.28467 1.112669          ?        ? 
1 1 1   18   21   10 o 48.10765 1.375222   23.63663   350.0   23.18562 1.323174          ?        ? 
1 1 1   18   21   11 o 52.57405 1.286991   55.25211    97.6   27.69645 1.353247          ?        ? 
1 1 1   18   21   12 o 49.46331 1.063945   67.13426    27.5   24.50880 1.052525          ?        ? 
1 1 1   18   21   13 o 18.10123 2.076665   15.24131   241.2   3.307936 0.7518036          ?        ? 
1 1 1   18   21   14 o 26.78479 1.459552   19.69717   346.9   7.217315 0.7818757          ?        ? 
1 1 1   18   21   15 o 15.17273 2.279284   18.73767    16.2   2.345627 0.6916593          ?        ? 
1 1 1   18   21   16 o 18.97900 1.901395   24.31401    45.5   3.668802 0.7217315          ?        ? 
1 1 1   18   21   17 o 15.87981 2.461855   26.50515    71.0   2.616277 0.7818757          ?        ? 
1 1 1   18   21   18 o 19.51058 2.620253   11.97214   233.7   4.029667 1.022453          ?        ? 
1 1 1   18   21   19 o 8.913280 3.397575   7.924226    35.1  0.7518036 0.8420200          ?        ? 
1 1 1   18   22    0 o 161.0215 2.157930   166.9462   180.0   259.7030 6.946666   259.7030 6.946666 
1 1 1   18   22    1 o 86.24147 1.220440   78.14652   166.2   74.42856 2.105050          ?        ? 
1 1 1   18   22    2 o 56.14326 1.258736   76.81277   232.0   31.54568 1.413391          ?        ? 
1 1 1   18   22    3 o 55.49590 1.219231   57.94938     7.9   30.82395 1.353247          ?        ? 
1 1 1   18   22    4 o 88.59347 1.391703   99.38002   357.9   78.57851 2.465916          ?        ? 
1 1 1   18   22    5 o 143.9671 1.597948   177.4856   351.1   207.5580 4.601038          ?        ? 
1 1 1   18   22    6 o 44.65375 1.548939   41.70737   160.8   19.96791 1.383319          ?        ? 
1 1 1   18   22    7 o 73.18167 1.335505   52.59812   118.5   53.61863 1.954689          ?        ? 
1 1 1   18   22    8 o 11.72775 4.215039   15.57202   240.2   1.172814 1.263030          ?        ? 
1 1 1   18   22    9 o 21.38402 2.601638   16.26877   117.7   4.601038 1.112669          ?        ? 
1 1 1   18   22   10 o 53.26281 1.270348   63.28341    87.4   28.41818 1.353247          ?        ? 
1 1 1   18   22   11 o 42.52924 1.414187   40.92911    51.5   18.13350 1.202886          ?        ? 
1 1 1   18   22   12 o 39.37944 1.221841   28.75481    41.5   15.54730 0.9623086          ?        ? 
1 1 1   18   22   13 o 57.31413 1.023145   71.13596   256.5   32.92900 1.172814          ?        ? 
1 1 1   18   22   14 o 20.62622 1.895344   28.57953   232.9   4.300317 0.7818757          ?        ? 
1 1 1   18   22   15 f 23.39853 1.670780   19.13839   223.9   5.533275 0.7818757          ?        ? 
1 1 1   18   22   16 o 11.29083 3.189082   12.46971    70.3   1.383319 0.7518036          ?        ? 
1 1 1   18   22   17 o 8.017663 3.248069   7.896554   304.8  0.3608657 0.8119479          ?        ? 
1 1 1   18   22   18 o 29.62757 1.522508   33.08537    58.4   8.961499 0.9021643          ?        ? 
1 1 1   18   22   19 o 6.447369 2.957589   12.38372   155.0 -0.4210100 0.8720922          ?        ? 
1 1 1   18   23    0 o 42.47148 2.099686   16.47155   180.0   18.19365 1.774257   18.19365 1.774257 
1 1 1   18   23    1 o 57.19676 1.314416   66.80141    89.5   32.74857 1.503607          ?        ? 
1 1 1   18   23    2 f 70.72598 1.275577   117.3788   285.6   50.07012 1.804329          ?        ? 
1 1 1   18   23    3 o 58.16393 1.266709   33.58394   118.1   33.86123 1.473535          ?        ? 
1 1 1   18   23    4 o 62.30315 1.303221   66.41664   294.4   38.85321 1.623896          ?        ? 
1 1 1   18   23    5 o 32.39440 2.227952   53.07417   277.9   10.52525 1.443463          ?        ? 
1 1 1   18   23    6 o 92.11048 1.403860   112.4126    86.0   84.95381 2.586205          ?        ? 
1 1 1   18   23    7 o 19.80432 3.779777   47.34594    93.1   4.089812 1.443463          ?        ? 
1 1 1   18   23    8 o 101.3990 1.304918   122.4995   212.5   102.9670 2.646349          ?        ? 
1 1 1   18   23    9 o 66.77061 1.306102   92.19068   143.2   44.65714 1.744184          ?        ? 
1 1 1   18   23   10 o 99.51498 1.208749   115.4170   115.5   99.20800 2.405771          ?        ? 
1 1 1   18   23   11 o 48.56595 1.176484   39.21101   355.2   23.63671 1.142741          ?        ? 
1 1 1   18   23   12 o 37.56698 1.280791   32.36056   181.0   14.16398 0.9623086          ?        ? 
1 1 1   18   23   13 o 35.57723 1.352422   22.87020   285.6   12.72052 0.9623086          ?        ? 
1 1 1   18   23   14 o 30.11929 1.497652   26.83388    31.2   9.141932 0.9021643          ?        ? 
1 1 1   18   23   15 f 21.97394 1.779098   20.13200   261.5   4.901759 0.7818757          ?        ? 
1 1 1   18   23   16 o 28.33874 1.538693   34.28686    26.7   8.149551 0.8720922          ?        ? 
1 1 1   18   23   17 o 21.18809 2.057977   28.55948   347.0   4.631110 0.8720922          ?        ? 
1 1 1   18   23   18 o 7.215628 3.135533   11.61361    63.5       0.03 0.8420200          ?        ? 
1 1 1   18   24    0 o 46.82363 2.031305   44.00452   360.0   22.07295 1.894545   22.07295 1.894545 
1 1 1   18   24    1 o 59.97197 1.228520   64.44175   250.2   35.99636 1.473535          ?        ? 
1 1 1   18   24    2 o 81.70731 1.269763   84.88627   204.6   66.82030 2.074978          ?        ? 
1 1 1   18   24    3 o 122.6488 1.422097   143.9603   230.1   150.6013 3.488369          ?        ? 
1 1 1   18   24    4 o 28.98203 1.971466   44.91724   274.6   8.420200 1.142741          ?        ? 
1 1 1   18   24    5 o 97.96821 1.273877   98.58039    99.8   96.08051 2.495988          ?        ? 
1 1 1   18   24    6 o 33.52702 2.152686   49.40702   258.6   11.27705 1.443463          ?        ? 
1 1 1   18   24    7 f 83.12112 1.356701   75.81305   146.8   69.19601 2.255411          ?        ? 
1 1 1   18   24    8 o 12.53730 4.287046   17.82187    26.9   1.473535 1.293102          ?        ? 
1 1 1   18   24    9 o 37.66874 1.955913   39.14484   171.8   14.25420 1.473535          ?        ? 
1 1 1   18   24   10 o 74.73367 1.207173   74.33198   269.4   55.96426 1.804329          ?        ? 
1 1 1   18   24   11 o 44.14886 1.260134   47.27419   236.1   19.54689 1.112669          ?        ? 
1 1 1   18   24   12 o 42.71557 1.267216   41.69556   178.6   18.31394 1.082597          ?        ? 
1 1 1   18   24   13 o 30.73568 1.418697   33.47068   124.8   9.502798 0.8720922          ?        ? 
1 1 1   18   24   14 f 45.10719 1.166693   49.69269    88.8   20.44906 1.052525          ?        ? 
1 1 1   18   24   15 o 28.82309 1.617170   35.57218   262.6   8.420200 0.9322364          ?        ? 
1 1 1   18   24   16 o 7.243583 3.141419   3.359436   110.2      -0.03 0.8420200          ?        ? 
1 1 1   18   24   17 o 10.14454 3.516393   7.393188   280.6   1.082597 0.8720922          ?        ? 
1 1 1   18   24   18 o 18.51318 2.436546   24.30779   117.1   3.668802 0.9021643          ?        ? 
1 1 1   18   25    0 o 104.4885 1.886486   135.5318     0.0   109.4025 3.939451   109.4025 3.939451 
1 1 1   18   25    1 o 117.2330 1.308232   107.1887    28.4   137.5801 3.067359          ?        ? 
1 1 1   18   25    2 o 113.2825 1.300761   128.2973    98.1   128.4682 2.947070          ?        ? 
1 1 1   18   25    3 o 103.3410 1.265846   110.8397   280.4   106.9065 2.616277          ?        ? 
1 1 1   18   25    4 o 115.7697 1.324768   123.4644   338.7   134.1819 3.067359          ?        ? 
1 1 1   18   25    5 o 89.53985 1.242653   93.13503   177.7   80.26255 2.225339          ?        ? 
1 1 1   18   25    6 o 30.13644 1.995733   27.02208   318.0   9.111859 1.202886          ?        ? 
1 1 1   18   25    7 o 38.12221 1.932647   30.96060   340.1   14.58499 1.473535          ?        ? 
1 1 1   18   25    8 o 61.75587 1.412161   86.04024    79.3   38.22169 1.744184          ?        ? 
1 1 1   18   25    9 o 16.15891 4.162701   30.31842   240.0   2.766637 1.353247          ?        ? 
1 1 1   18   25   10 o 55.59161 1.217132   67.65326   163.5   30.97431 1.353247          ?        ? 
1 1 1   18   25   11 o 48.75920 1.171821   58.19554   133.6   23.84721 1.142741          ?        ? 
1 1 1   18   25   12 o 58.83768 1.098872   68.08408    76.9   34.73333 1.293102          ?        ? 
1 1 1   18   25   13 o 16.97849 2.568227   19.71352   117.7   2.947070 0.8720922          ?        ? 
1 1 1   18   25   14 o 36.06591 1.334097   38.67255   229.7   13.11145 0.9623086          ?        ? 
1 1 1   18   25   15 o 7.383231 3.226930   9.023100   254.8      -0.09 0.9021643          ?        ? 
1 1 1   18   25   16 o 50.16403 1.198952   54.09221   285.6   25.41096 1.202886          ?        ? 
1 1 1   18   25   17 o 13.83348 3.211165   16.81175   220.7   2.165194 0.8720922          ?        ? 
1 1 1   18   25   18 o 18.79408 2.400129   12.09793   347.1   3.789090 0.9021643          ?        ? 
1 1 1   18   26    0 o 25.12959 3.386725   51.54243   180.0   6.676016 1.653968   6.676016 1.653968 
1 1 1   18   26    1 f 61.76283 1.338967   84.75433   290.8   38.19162 1.653968          ?        ? 
1 1 1   18   26    2 o 80.36506 1.272260   89.13181    31.3   64.65511 2.044906          ?        ? 
1 1 1   18   26    3 o 40.74068 1.660805   22.96191   251.3   16.62990 1.353247          ?        ? 
1 1 1   18   26    4 o 102.1677 1.368685   116.0416    29.0   104.5308 2.796710          ?        ? 
1 1 1   18   26    5 o 121.7049 1.420771   97.09379   357.8   148.3760 3.458297          ?        ? 
1 1 1   18   26    6 o 79.76920 1.225216   77.45932   335.7   63.72287 1.954689          ?        ? 
1 1 1   18   26    7 o 15.74448 3.768996   28.85903   195.9   2.616277 1.172814          ?        ? 
1 1 1   18   26    8 o 34.39243 1.879923   51.68145    73.9   11.87850 1.293102          ?        ? 
1 1 1   18   26    9 o 9.441036 4.035647   13.59471   161.3   0.000000 1.353247          ?        ? 
1 1 1   18   26   10 f 45.92500 1.342360   41.51730   297.1   21.17079 1.232958          ?        ? 
1 1 1   18   26   11 f 55.12109 1.227522   63.42407   273.9   30.49315 1.353247          ?        ? 
1 1 1   18   26   12 o 40.46190 1.263476   39.96097   197.2   16.44946 1.022453          ?        ? 
1 1 1   18   26   13 o 27.39158 1.646791   37.04885   192.4   7.578181 0.9021643          ?        ? 
1 1 1   18   26   14 o 25.92565 1.739907   24.98193   250.4   6.826377 0.9021643          ?        ? 
1 1 1   18   26   15 o 39.64344 1.403346   28.40116   212.4   15.90816 1.112669          ?        ? 
1 1 1   18   26   16 o 12.82115 3.444296   12.16090    94.3   1.864473 0.9021643          ?        ? 
1 1 1   18   26   17 o 6.714056 3.091186   12.17718    94.0 -0.5112265 0.9623086          ?        ? 
1 1 1   18   27    0 o 60.93536 1.904100   72.65797   180.0   37.28946 2.315555   37.28946 2.315555 
1 1 1   18   27    1 o 24.40176 2.587990   36.12378    62.2   5.984357 1.263030          ?        ? 
1 1 1   18   27    2 o 42.42963 1.701008   70.78973   165.5   18.04329 1.443463          ?        ? 
1 1 1   18   27    3 o 52.75045 1.482216   65.71775   272.4   27.87688 1.563751          ?        ? 
1 1 1   18   27    4 o 120.4763 1.297974   121.7449   288.8   145.3687 3.127503          ?        ? 
1 1 1   18   27    5 o 9.006531 3.825928   27.60245   313.6       0.03 1.202886          ?        ? 
1 1 1   18   27    6 o 39.06267 1.693656   30.16787    78.2   15.30672 1.323174          ?        ? 
1 1 1   18   27    7 o 55.15906 1.362974   51.91709   346.3   30.49315 1.503607          ?        ? 
1 1 1   18   27    8 o 81.95588 1.265912   73.34737   350.2   67.33153 2.074978          ?        ? 
1 1 1   18   27    9 o 34.62057 1.824103   33.61726   152.7   12.05893 1.263030          ?        ? 
1 1 1   18   27   10 o 27.95113 1.936589   35.14578   265.8   7.878902 1.082597          ?        ? 
1 1 1   18   27   11 o 12.99760 3.661666   21.66920   291.3   1.804329 0.9923807          ?        ? 
1 1 1   18   27   12 o 37.87955 1.309916   43.30640   358.6   14.43463 0.9923807          ?        ? 
1 1 1   18   27   13 o 28.24444 1.756772   31.25387    28.7   8.089407 0.9923807          ?        ? 
1 1 1   18   27   14 o 22.99824 2.026756   12.89961    51.1   5.412986 0.9322364          ?        ? 
1 1 1   18   27   15 o 20.46441 2.498124   26.43759    49.4   4.360461 1.022453          ?        ? 
1 1 1   18   27   16 o 10.78726 3.698155   10.42092   143.4   1.263030 0.9623086          ?        ? 
1 1 1   18   27   17 o 9.456903 3.624183   11.65406    81.2  0.8720922 0.9623086          ?        ? 
1 1 1   18   28    0 o 66.10458 1.891327   47.48799     0.0   43.87526 2.495988   43.87526 2.495988 
1 1 1   18   28    1 o 103.1164 1.268603   121.9083    80.4   106.4855 2.616277          ?        ? 
1 1 1   18   28    2 o 112.1156 1.435001   130.7406   229.7   125.9421 3.217719          ?        ? 
1 1 1   18   28    3 o 88.44843 1.189987   92.17842   228.5   78.33794 2.105050          ?        ? 
1 1 1   18   28    4 o 43.43726 1.592318   66.81194   133.9   18.91538 1.383319          ?        ? 
1 1 1   18   28    5 o 12.12020 4.273981   15.22002   201.9   1.323174 1.293102          ?        ? 
1 1 1   18   28    6 o 49.44065 1.490206   45.90626   284.7   24.50880 1.473535          ?        ? 
1 1 1   18   28    7 o 37.90151 1.785215   26.01047   251.4   14.43463 1.353247          ?        ? 
1 1 1   18   28    8 o 9.119147 3.873603   21.12112   179.5       0.06 1.232958          ?        ? 
1 1 1   18   28    9 o 37.74785 1.433985   49.35942    23.4   14.31434 1.082597          ?        ? 
1 1 1   18   28   10 o 20.22802 2.304319   16.39173   171.5   4.149956 0.9322364          ?        ? 
1 1 1   18   28   11 o 43.98043 1.367524   37.34709   328.8   19.45668 1.202886          ?        ? 
1 1 1   18   28   12 f 41.78853 1.403272   39.04264   300.9   17.59221 1.172814          ?        ? 
1 1 1   18   28   13 f 20.37279 2.361750   29.33245    77.7   4.270245 0.9623086          ?        ? 
1 1 1   18   28   14 o 31.49791 1.575312   39.20977   212.6   10.07417 0.9923807          ?        ? 
1 1 1   18   28   15 o 6.140939 2.939964   14.04842    99.4  -1.232958 1.022453          ?        ? 
1 1 1   18   28   16 o 17.37156 3.144976   16.85802   247.5   3.398152 1.052525          ?        ? 
1 1 1   18   28   17 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   18   29    0 o 83.84177 1.867182   73.18726   180.0   70.51918 3.127503   70.51918 3.127503 
1 1 1   18   29    1 o 121.3125 1.375789   105.7236   178.2   147.4437 3.338008          ?        ? 
1 1 1   18   29    2 o 33.94641 2.126091   63.70885   301.1   11.57778 1.443463          ?        ? 
1 1 1   18   29    3 o 57.94817 1.349268   61.58717    75.5   33.65073 1.563751          ?        ? 
1 1 1   18   29    4 o 10.64219 4.059632   6.429046   287.4  0.8119479 1.202886          ?        ? 
1 1 1   18   29    5 f 25.25577 2.679084   27.85312     3.2   6.435439 1.353247          ?        ? 
1 1 1   18   29    6 o 58.59600 1.360011   52.91890   112.8   34.43261 1.593824          ?        ? 
1 1 1   18   29    7 o 17.42493 3.654787   25.28839   204.2   3.217719 1.232958          ?        ? 
1 1 1   18   29    8 o 60.11600 1.400659   61.74302   241.9   36.29708 1.684040          ?        ? 
1 1 1   18   29    9 o 19.13845 2.671201   6.751357   151.4   3.728946 1.022453          ?        ? 
1 1 1   18   29   10 o 29.87100 1.610774   26.48390   130.8   8.991571 0.9623086          ?        ? 
1 1 1   18   29   11 o 30.71042 1.713629   28.39655   203.1   9.532870 1.052525          ?        ? 
1 1 1   18   29   12 o 27.47286 1.806111   29.12032   181.0   7.668397 0.9923807          ?        ? 
1 1 1   18   29   13 o 9.683599 3.649324   8.201604   124.2  0.8119479 0.9623086          ?        ? 
1 1 1   18   29   14 o 36.34344 1.406654   26.14512    76.9   13.38210 1.022453          ?        ? 
1 1 1   18   29   15 o 17.32130 2.864625   24.27443   257.8   3.217719 0.9923807          ?        ? 
1 1 1   18   29   16 o 6.628323 3.084963   12.98120   208.4 -0.6315150 0.9923807          ?        ? 
1 1 1   18   30    0 o 142.1189 2.148824   148.0038     0.0   202.6862 6.104645   202.6862 6.104645 
1 1 1   18   30    1 o 50.75739 1.481171   41.77617    56.1   25.83197 1.503607          ?        ? 
1 1 1   18   30    2 o 28.13642 2.351356   21.57981   221.6   7.969118 1.323174          ?        ? 
1 1 1   18   30    3 o 86.02027 1.206098   87.87750   132.7   74.12784 2.074978          ?        ? 
1 1 1   18   30    4 o 59.15922 1.372479   59.43443   293.4   35.09419 1.623896          ?        ? 
1 1 1   18   30    5 o 35.40247 1.868760   31.58869     3.2   12.60023 1.323174          ?        ? 
1 1 1   18   30    6 o 45.34195 1.624914   44.69195   189.2   20.65956 1.473535          ?        ? 
1 1 1   18   30    7 o 9.881048 3.973802   5.289441   340.4  0.5112265 1.202886          ?        ? 
1 1 1   18   30    8 f 19.67386 3.209919   8.592014    16.9   3.969523 1.263030          ?        ? 
1 1 1   18   30    9 o 24.61438 2.076942   18.04049    10.2   6.134717 1.022453          ?        ? 
1 1 1   18   30   10 f 44.97842 1.337181   46.74299    87.1   20.35884 1.202886          ?        ? 
1 1 1   18   30   11 o 23.98290 2.131629   32.31579   122.3   5.864068 1.022453          ?        ? 
1 1 1   18   30   12 o 36.68782 1.516402   41.30252   290.0   13.62268 1.112669          ?        ? 
1 1 1   18   30   13 o 32.33205 1.581175   33.09154   294.9   10.61547 1.022453          ?        ? 
1 1 1   18   30   14 o 6.348212 2.930406   15.28871    15.6 -0.5713707 0.8720922          ?        ? 
1 1 1   18   30   15 o 18.35241 2.949469   11.72906     4.0   3.668802 1.082597          ?        ? 
1 1 1   18   30   16 o 14.91578 3.570405   17.64721    89.2   2.676421 1.052525          ?        ? 
1 1 1   18   31    0 o 58.58332 2.058852   83.91226     0.0   34.55289 2.405771   34.55289 2.405771 
1 1 1   18   31    1 o 122.8505 1.383044   127.1690   131.1   151.3531 3.398152          ?        ? 
1 1 1   18   31    2 o 42.55606 1.731287   58.42982    93.6   18.19365 1.473535          ?        ? 
1 1 1   18   31    3 o 41.24444 1.640520   47.16159   179.1   17.08098 1.353247          ?        ? 
1 1 1   18   31    4 o 8.224962 3.710806   9.307847   273.3 -0.6315150 1.293102          ?        ? 
1 1 1   18   31    5 f 28.32380 2.388885   59.27878   192.5   8.119479 1.353247          ?        ? 
1 1 1   18   31    6 f 30.03038 2.152990   25.33061   319.2   9.111859 1.293102          ?        ? 
1 1 1   18   31    7 o 13.18623 4.176661   16.98207   131.6   1.804329 1.232958          ?        ? 
1 1 1   18   31    8 o 18.32471 3.739804   26.12538    84.9   3.608657 1.323174          ?        ? 
1 1 1   18   31    9 o 15.01786 3.471042   18.96154    55.8   2.435844 1.022453          ?        ? 
1 1 1   18   31   10 o 59.01289 1.146569   54.50134     9.2   35.00398 1.353247          ?        ? 
1 1 1   18   31   11 o 16.04238 3.472284   12.22018   174.5   2.826782 1.082597          ?        ? 
1 1 1   18   31   12 o 8.905181 3.597761   4.618438   335.8  0.4811543 0.9923807          ?        ? 
1 1 1   18   31   13 o 10.32765 3.630246   11.16166   294.3   1.082597 0.9322364          ?        ? 
1 1 1   18   31   14 f 15.37096 3.322293   17.07682    27.2   2.676421 0.9923807          ?        ? 
1 1 1   18   31   15 o 13.11021 3.724260   13.77732    78.7   2.074978 1.022453          ?        ? 
1 1 1   18   32    0 o 12.77092 6.442207   26.57259     0.0   2.495988 2.014834   2.495988 2.014834 
1 1 1   18   32    1 o 24.48483 2.763439   29.78928   279.8   6.074574 1.353247          ?        ? 
1 1 1   18   32    2 o 8.232092 3.744464   15.24411    96.1 -0.7818757 1.353247          ?        ? 
1 1 1   18   32    3 f 12.92609 4.336607   4.434124   188.5   1.653968 1.323174          ?        ? 
1 1 1   18   32    4 o 72.81589 1.321564   61.60115   204.8   53.22770 1.924617          ?        ? 
1 1 1   18   32    5 o 61.68637 1.389377   62.12382   145.8   38.22169 1.714112          ?        ? 
1 1 1   18   32    6 o 52.59842 1.429327   76.56287    32.4   27.81673 1.503607          ?        ? 
1 1 1   18   32    7 o 44.76969 1.679269   45.23358   136.9   20.20848 1.503607          ?        ? 
1 1 1   18   32    8 o 23.52410 2.812380   33.34266   111.1   5.683635 1.323174          ?        ? 
1 1 1   18   32    9 o 52.56269 1.230057   53.03614   241.7   27.78666 1.293102          ?        ? 
1 1 1   18   32   10 o 38.16926 1.496939   31.74097   155.3   14.73535 1.142741          ?        ? 
1 1 1   18   32   11 o 62.40542 1.132426   61.47926   187.0   39.24415 1.413391          ?        ? 
1 1 1   18   32   12 o 38.60626 1.518942   32.54121    89.1   15.12629 1.172814          ?        ? 
1 1 1   18   32   13 o 13.48132 3.762300   5.263397   189.3   2.105050 1.052525          ?        ? 
1 1 1   18   32   14 o 22.70930 2.251177   18.19862    61.2   5.443058 1.022453          ?        ? 
1 1 1   18   32   15 x        ?      ?   11.03400   153.3          ?        ?          ?        ? 
1 1 1   18   33    0 o 16.22338 6.679521   25.38480   360.0   3.819162 2.135122   3.819162 2.135122 
1 1 1   18   33    1 o 32.47041 2.083815   30.26916   328.8   10.64554 1.353247          ?        ? 
1 1 1   18   33    2 o 94.95120 1.330189   87.98686    82.4   90.51716 2.526060          ?        ? 
1 1 1   18   33    3 o 51.97348 1.504374   51.69800   111.1   27.15515 1.563751          ?        ? 
1 1 1   18   33    4 o 13.49109 4.036021   34.21185   119.5   1.924617 1.172814          ?        ? 
1 1 1   18   33    5 o 51.67265 1.425837   61.48449   240.0   26.85443 1.473535          ?        ? 
1 1 1   18   33    6 o 41.52536 1.629422   46.13774    77.7   17.38170 1.353247          ?        ? 
1 1 1   18   33    7 o 41.19833 1.678853   45.04175   130.8   17.14112 1.383319          ?        ? 
1 1 1   18   33    8 o 64.10606 1.196205   61.81673   129.8   41.31913 1.533679          ?        ? 
1 1 1   18   33    9 o 29.76080 1.919877   28.45287    64.5   9.021644 1.142741          ?        ? 
1 1 1   18   33   10 o 34.38581 1.617920   44.71701    93.3   11.99879 1.112669          ?        ? 
1 1 1   18   33   11 o 12.62838 3.695838   18.11152   246.4   1.774257 0.9923807          ?        ? 
1 1 1   18   33   12 o 59.41440 1.240049   57.91933   289.2   35.72571 1.473535          ?        ? 
1 1 1   18   33   13 o 31.46799 1.767939   35.73722   316.7   10.19446 1.112669          ?        ? 
1 1 1   18   33   14 o 14.40515 3.647781   14.25448   249.6   2.495988 1.052525          ?        ? 
1 1 1   18   34    0 o 7.032462 4.783523   9.973567   180.0 -0.7818757 1.954689 -0.7818757 1.954689 
1 1 1   18   34    1 o 39.94411 1.769210   37.08757    13.4   16.08860 1.413391          ?        ? 
1 1 1   18   34    2 f 45.70321 1.677868   38.48927    22.2   21.05050 1.533679          ?        ? 
1 1 1   18   34    3 o 57.25760 1.365541   63.15962   172.8   32.95907 1.563751          ?        ? 
1 1 1   18   34    4 o 44.74830 1.612869   45.01956   137.1   20.17841 1.443463          ?        ? 
1 1 1   18   34    5 o 16.83300 4.060564   8.242227   314.5   3.097431 1.353247          ?        ? 
1 1 1   18   34    6 o 7.757713 3.558936   8.104514     9.9 -0.8119479 1.263030          ?        ? 
1 1 1   18   34    7 o 65.13229 1.292784   60.65717    76.2   42.70245 1.684040          ?        ? 
1 1 1   18   34    8 o 18.68210 2.897418   24.25546   339.1   3.638730 1.082597          ?        ? 
1 1 1   18   34    9 o 13.36571 3.701032   21.11425   145.2   1.984761 1.022453          ?        ? 
1 1 1   18   34   10 f 19.20363 2.897029   30.22633   105.7   3.879307 1.112669          ?        ? 
1 1 1   18   34   11 o 28.52948 2.055442   34.26083   180.7   8.390128 1.172814          ?        ? 
1 1 1   18   34   12 o 11.33191 3.918838   6.605419   230.7   1.413391 1.082597          ?        ? 
1 1 1   18   34   13 o 22.17334 2.441214   24.47598    61.7   5.262625 1.082597          ?        ? 
1 1 1   18   35    0 o 41.69931 2.728254   76.91747   180.0   17.80271 2.255411   17.80271 2.255411 
1 1 1   18   35    1 o 39.84879 1.924374   43.01857   320.4   16.05853 1.533679          ?        ? 
1 1 1   18   35    2 o 15.16192 4.463766   15.09191   320.9   2.495988 1.443463          ?        ? 
1 1 1   18   35    3 o 37.16048 1.942202   42.41301   309.7   13.98355 1.443463          ?        ? 
1 1 1   18   35    4 o 28.96554 2.439780   29.36019   291.9   8.570561 1.413391          ?        ? 
1 1 1   18   35    5 o 18.80542 3.403141   25.25335   251.3   3.789090 1.232958          ?        ? 
1 1 1   18   35    6 o 8.585318 3.784001   6.022503   138.6 -0.2105050 1.263030          ?        ? 
1 1 1   18   35    7 o 9.958310 4.134025   15.36902   197.4  0.4510822 1.353247          ?        ? 
1 1 1   18   35    8 o 33.63465 1.788165   41.26772   190.5   11.51763 1.202886          ?        ? 
1 1 1   18   35    9 o 11.00377 3.858364   9.566936   116.7   1.232958 1.052525          ?        ? 
1 1 1   18   35   10 o 13.12723 3.866051   15.69758   198.4   1.954689 1.082597          ?        ? 
1 1 1   18   35   11 o 9.080869 3.725522   9.436115    58.8  0.5112265 1.082597          ?        ? 
1 1 1   18   35   12 o 18.11576 2.987999   19.98146   350.3   3.608657 1.082597          ?        ? 
1 1 1   18   35   13 o 12.65051 3.961362   15.06540   352.9   1.984761 1.112669          ?        ? 
1 1 1   18   36    0 o 40.29362 2.865170   66.74181   180.0   16.72011 2.285483   16.72011 2.285483 
1 1 1   18   36    1 o 57.16616 1.525539   61.85820   203.4   32.95907 1.744184          ?        ? 
1 1 1   18   36    2 o 8.080095 3.655237   12.04675   249.4 -0.5713707 1.263030          ?        ? 
1 1 1   18   36    3 f 54.11171 1.500503   49.12579    32.7   29.53085 1.623896          ?        ? 
1 1 1   18   36    4 o 34.24007 2.063942   27.29563   358.5   11.93864 1.413391          ?        ? 
1 1 1   18   36    5 o 31.24819 2.261556   18.69649   158.1   10.01402 1.413391          ?        ? 
1 1 1   18   36    6 o 23.16457 2.856030   11.22068    29.6   5.593419 1.323174          ?        ? 
1 1 1   18   36    7 o 27.59065 2.670353   17.94481   248.2   7.939046 1.473535          ?        ? 
1 1 1   18   36    8 o 24.68019 2.436946   22.43181   319.1   6.315150 1.202886          ?        ? 
1 1 1   18   36    9 o 29.70141 1.923716   39.49446   340.3   9.051716 1.142741          ?        ? 
1 1 1   18   36   10 o 56.43376 1.358832   55.15926   261.0   32.35763 1.533679          ?        ? 
1 1 1   18   36   11 o 10.20712 3.901295   6.031221    28.1   1.022453 1.112669          ?        ? 
1 1 1   18   36   12 o 9.510032 3.791262   7.472299   344.5  0.8119479 1.082597          ?        ? 
1 1 1   18   37    0 o 34.56149 3.410571   45.19362    -0.0   12.60023 2.315555   12.60023 2.315555 
1 1 1   18   37    1 o 10.28088 4.182729   17.81168   122.6  0.6014429 1.353247          ?        ? 
1 1 1   18   37    2 o 24.84027 2.784428   24.35796    33.1   6.405366 1.383319          ?        ? 
1 1 1   18   37    3 o 11.65477 4.378697   13.43729     8.5   1.232958 1.383319          ?        ? 
1 1 1   18   37    4 o 66.53183 1.355989   69.62936   150.2   44.68721 1.804329          ?        ? 
1 1 1   18   37    5 o 17.00915 4.106926   10.68117   245.7   3.277864 1.383319          ?        ? 
1 1 1   18   37    6 o 18.90550 3.628902   11.74736    29.0   3.969523 1.323174          ?        ? 
1 1 1   18   37    7 o 22.77870 3.102439   17.01824   293.7   5.503202 1.413391          ?        ? 
1 1 1   18   37    8 o 22.05225 2.659170   21.67778   171.4   5.112265 1.172814          ?        ? 
1 1 1   18   37    9 o 29.98704 2.055818   23.98077   168.3   9.322365 1.232958          ?        ? 
1 1 1   18   37   10 o 26.98529 2.284500   27.95203   108.1   7.668397 1.232958          ?        ? 
1 1 1   18   37   11 o 27.54531 2.183468   28.33927   302.2   8.029263 1.202886          ?        ? 
1 1 1   18   38    0 o 13.91196 6.377042   5.080817   180.0   3.067359 1.924617   3.067359 1.924617 
1 1 1   18   38    1 o 46.65844 1.772421   41.59653   358.9   22.13310 1.653968          ?        ? 
1 1 1   18   38    2 o 31.56174 2.429649   32.52982   196.8   10.28467 1.533679          ?        ? 
1 1 1   18   38    3 o 22.53136 3.336699   19.58209   133.8   5.412986 1.503607          ?        ? 
1 1 1   18   38    4 o 31.74857 2.367992   31.94337   115.2   10.43503 1.503607          ?        ? 
1 1 1   18   38    5 o 19.65707 3.574156   24.62082   293.8   4.270245 1.353247          ?        ? 
1 1 1   18   38    6 o 11.16028 4.291958   8.400934   129.7   1.112669 1.353247          ?        ? 
1 1 1   18   38    7 o 7.819854 3.625207   7.508766   152.5 -0.8420200 1.353247          ?        ? 
1 1 1   18   38    8 o 14.59758 4.071451   8.738603   168.6   2.526060 1.232958          ?        ? 
1 1 1   18   38    9 o 34.22831 1.757150   38.29842   202.2   12.08900 1.202886          ?        ? 
1 1 1   18   38   10 f 21.05297 2.856808   19.95380   250.0   4.871688 1.202886          ?        ? 
1 1 1   18   39    0 o 5.857977 4.159814   5.423014     0.0  -1.834401 1.894545  -1.834401 1.894545 
1 1 1   18   39    1 o 42.84383 1.895134   46.44869   298.6   18.76502 1.623896          ?        ? 
1 1 1   18   39    2 o 17.77266 4.135004   13.65529    15.4   3.608657 1.443463          ?        ? 
1 1 1   18   39    3 o 8.808588 3.930018   12.36530    73.9 -0.3007214 1.413391          ?        ? 
1 1 1   18   39    4 o 31.47655 2.388456   31.68533    14.1   10.28467 1.503607          ?        ? 
1 1 1   18   39    5 o 40.20150 1.982294   46.15192    44.5   16.62990 1.593824          ?        ? 
1 1 1   18   39    6 o 13.79333 4.482008   9.998009   310.7   2.255411 1.413391          ?        ? 
1 1 1   18   39    7 o 16.29292 4.347599   18.59523    82.7   3.217719 1.443463          ?        ? 
1 1 1   18   39    8 o 37.61602 1.678846   32.96761    38.2   14.58499 1.263030          ?        ? 
1 1 1   18   39    9 o 20.39231 2.949360   11.75756   220.8   4.601038 1.202886          ?        ? 
1 1 1   18   40    0 o 10.89935 6.171760   12.15592   180.0   1.954689 2.044906   1.954689 2.044906 
1 1 1   18   40    1 o 26.59054 2.883882   28.71730   223.9   7.487964 1.533679          ?        ? 
1 1 1   18   40    2 o 40.03622 1.952921   33.04214     5.2   16.47953 1.563751          ?        ? 
1 1 1   18   40    3 o 7.731586 3.615365   5.986650   127.2 -0.9923807 1.383319          ?        ? 
1 1 1   18   40    4 o 8.831898 3.901608   7.348073   198.8      -0.06 1.353247          ?        ? 
1 1 1   18   40    5 f 6.237996 3.074328   5.187586   115.5  -2.646349 1.383319          ?        ? 
1 1 1   18   40    6 o 16.10369 4.497679   17.19821   340.5   3.217719 1.503607          ?        ? 
1 1 1   18   40    7 o 27.87351 2.859029   31.18699    42.1   8.510417 1.593824          ?        ? 
1 1 1   18   40    8 o 9.238362 3.842690   12.34574   186.7  0.6014429 1.172814          ?        ? 
1 1 1   18   41    0 o 21.16264 5.605949   26.14490   180.0   5.773852 2.044906   5.773852 2.044906 
1 1 1   18   41    1 o 10.97133 4.404032   5.106939   263.9   1.022453 1.473535          ?        ? 
1 1 1   18   41    2 o 17.87947 4.118756   15.55671   314.7   3.789090 1.443463          ?        ? 
1 1 1   18   41    3 o 41.89312 1.902250   37.46213    57.0   18.13350 1.593824          ?        ? 
1 1 1   18   41    4 o 9.184074 4.062431   2.650628   311.9       0.03 1.473535          ?        ? 
1 1 1   18   41    5 o 15.05137 4.583477   17.37727     7.4   2.916998 1.503607          ?        ? 
1 1 1   18   41    6 f 11.57146 4.544028   21.47112   269.9   1.473535 1.533679          ?        ? 
1 1 1   18   41    7 o 10.61868 4.292141   12.41423   347.4   1.112669 1.413391          ?        ? 
1 1 1   18   42    0 o 25.07842 4.904448   24.69761   180.0   7.608253 2.195267   7.608253 2.195267 
1 1 1   18   42    1 o 22.56531 3.464945   17.59849   356.8   5.773852 1.563751          ?        ? 
1 1 1   18   42    2 o 42.22171 1.994282   38.47444    19.0   18.64473 1.684040          ?        ? 
1 1 1   18   42    3 o 8.333378 3.876212   8.276235   262.4 -0.7217315 1.563751          ?        ? 
1 1 1   18   42    4 o 12.70952 4.554265   11.81740   312.5   2.014834 1.473535          ?        ? 
1 1 1   18   42    5 o 8.637094 3.907390   3.475674   183.9 -0.1503607 1.443463          ?        ? 
1 1 1   18   43    0 o 7.402117 5.076776       0.10   180.0 -0.4510822 2.285483 -0.4510822 2.285483 
1 1 1   18   43    1 o 27.96381 2.849797   21.97454   240.1   8.630706 1.593824          ?        ? 
1 1 1   18   43    2 f 8.737582 3.967078   14.56649    44.8 -0.1804329 1.503607          ?        ? 
1 1 1   19    0    1 o 8.028448 4.295846   54.44809    90.0  0.9322364 0.9322364  0.9322364 0.9322364 
1 1 1   19    0    2 o 231.8055 2.270766   292.3852    90.0   537.6899 10.52525   537.6899 10.52525 
1 1 1   19    0    3 o 101.4672 1.363869   126.6078    90.0   103.0272 2.766637   103.0272 2.766637 
1 1 1   19    0    4 o 86.76206 1.213649   16.17018    90.0   75.33072 2.105050   75.33072 2.105050 
1 1 1   19    0    5 o 80.03960 1.184085   142.4178   270.0   64.11382 1.894545   64.11382 1.894545 
1 1 1   19    0    6 o 60.50864 1.143988   59.44648    90.0   36.65794 1.383319   36.65794 1.383319 
1 1 1   19    0    7 o 61.54869 1.051156   140.5186    90.0   37.92097 1.293102   37.92097 1.293102 
1 1 1   19    0    8 o 204.2086 1.922151   278.3959    90.0   417.3713 7.848830   417.3713 7.848830 
1 1 1   19    0    9 o 45.70505 1.087001   62.02814    90.0   20.93021 0.9923807   20.93021 0.9923807 
1 1 1   19    0   10 o 82.74421 1.218098   118.4104   270.0   68.53442 2.014834   68.53442 2.014834 
1 1 1   19    0   11 f 14.02969 7.149214   1.022977    90.0   2.947070 2.495988   2.947070 2.495988 
1 1 1   19    0   12 o 86.08718 1.818281   76.42247   270.0   74.27820 3.127503   74.27820 3.127503 
1 1 1   19    0   13 o 4.558559 3.296042   13.45388   270.0  -2.135122 1.383319  -2.135122 1.383319 
1 1 1   19    0   14 o 11.29627 3.084353   5.913727   270.0   1.533679 0.6014429   1.533679 0.6014429 
1 1 1   19    0   15 o 70.08421 1.159241   62.36425    90.0   49.19803 1.623896   49.19803 1.623896 
1 1 1   19    0   16 o 52.77854 1.226498   64.31432    90.0   27.93702 1.293102   27.93702 1.293102 
1 1 1   19    0   17 o 21.27501 2.160480   32.42308    90.0   4.691255 0.9021643   4.691255 0.9021643 
1 1 1   19    0   18 o 4.488919 3.095465   9.689817    90.0 -0.5112265 0.8720922 -0.5112265 0.8720922 
1 1 1   19    0   19 o 40.30420 1.421512   52.58587   270.0   16.38932 1.142741   16.38932 1.142741 
1 1 1   19    0   20 o 15.87052 3.827910   20.42811    90.0   3.007215 1.052525   3.007215 1.052525 
1 1 1   19    0   21 o 10.39163 4.511374   15.04940   270.0   1.653968 0.9623086   1.653968 0.9623086 
1 1 1   19    1    0 f 35.88223 1.345044   52.27950   180.0   12.93102 0.9623086   12.93102 0.9623086 
1 1 1   19    1    1 o 147.6230 1.140771   197.4239    82.8   217.9629 3.368080          ?        ? 
1 1 1   19    1    2 o 22.73978 1.388569   69.61712    23.5   5.172409 0.6315150          ?        ? 
1 1 1   19    1    3 o 156.6223 1.152025   219.1088   212.6   245.3586 3.608657          ?        ? 
1 1 1   19    1    4 o 125.9003 1.050970   175.7801   195.4   158.5403 2.646349          ?        ? 
1 1 1   19    1    5 o 122.9401 1.027354   146.1310   234.1   151.1727 2.526060          ?        ? 
1 1 1   19    1    6 o 38.73448 0.8151847   42.72587   255.4   15.00600 0.6315150          ?        ? 
1 1 1   19    1    7 o 128.3334 0.9724625   154.6805   347.2   164.7352 2.495988          ?        ? 
1 1 1   19    1    8 o 103.5581 0.8421286   147.1207   303.0   107.2673 1.744184          ?        ? 
1 1 1   19    1    9 o 115.8495 1.258960   196.0223   202.5   134.3022 2.916998          ?        ? 
1 1 1   19    1   10 o 121.4054 1.263271   173.0714   115.9   147.5039 3.067359          ?        ? 
1 1 1   19    1   11 o 23.11424 1.821431   36.98521   249.1   5.352841 0.8420200          ?        ? 
1 1 1   19    1   12 f 35.74058 0.9676107   57.68699   334.3   12.78066 0.6916593          ?        ? 
1 1 1   19    1   13 o 118.3763 1.155876   160.7153    59.4   140.2565 2.736565          ?        ? 
1 1 1   19    1   14 o 34.96251 1.161169   32.38737    78.9   12.23936 0.8119479          ?        ? 
1 1 1   19    1   15 o 43.06657 1.291802   41.75249   316.1   18.58459 1.112669          ?        ? 
1 1 1   19    1   16 o 24.86086 1.149137   22.37190   281.4   6.194862 0.5713707          ?        ? 
1 1 1   19    1   17 o 40.66086 0.9244807   45.69343   290.0   16.56975 0.7518036          ?        ? 
1 1 1   19    1   18 o 8.376225 2.983461   14.56398    61.2  0.6315150 0.6315150          ?        ? 
1 1 1   19    1   19 o 34.00700 1.105366   46.52879   353.4   11.63792 0.7518036          ?        ? 
1 1 1   19    1   20 o 24.19660 1.615673   25.47197   286.3   5.954284 0.7818757          ?        ? 
1 1 1   19    1   21 o 7.958109 3.202407   10.82291   294.7  0.4210100 0.7818757          ?        ? 
1 1 1   19    2    0 f 44.68912 1.348543   42.40061   180.0   20.02805 1.202886   20.02805 1.202886 
1 1 1   19    2    1 o 143.4075 1.142849   198.8512   272.7   205.6935 3.277864          ?        ? 
1 1 1   19    2    2 o 51.70236 0.8433775   85.58311   227.5   26.73414 0.8720922          ?        ? 
1 1 1   19    2    3 o 11.64999 2.641646   76.46429   266.9   1.413391 0.6014429          ?        ? 
1 1 1   19    2    4 o 188.7419 1.362267   306.3845   274.5   356.3549 5.142337          ?        ? 
1 1 1   19    2    5 o 55.70535 0.7827725   103.4426    59.7   31.03445 0.8720922          ?        ? 
1 1 1   19    2    6 o 34.59263 0.8693224   89.33040   219.3   11.96871 0.6014429          ?        ? 
1 1 1   19    2    7 o 21.65620 1.041462   51.62516   346.0   4.691255 0.4510822          ?        ? 
1 1 1   19    2    8 o 32.94160 1.141116   53.99680     7.9   10.85604 0.7518036          ?        ? 
1 1 1   19    2    9 o 48.79388 0.9244646   73.29762   334.6   23.81714 0.9021643          ?        ? 
1 1 1   19    2   10 o 25.52756 1.708139   37.89931   181.4   6.525656 0.8720922          ?        ? 
1 1 1   19    2   11 o 31.34210 1.343273   58.98554    99.7   9.833591 0.8420200          ?        ? 
1 1 1   19    2   12 o 64.37466 1.097785   81.69624   111.4   41.46949 1.413391          ?        ? 
1 1 1   19    2   13 o 37.57404 1.280550   41.66610    73.7   14.13391 0.9623086          ?        ? 
1 1 1   19    2   14 o 13.75396 3.130403   30.53172   306.4   1.984761 0.8420200          ?        ? 
1 1 1   19    2   15 o 33.02892 1.684387   53.44138   279.2   10.94626 1.112669          ?        ? 
1 1 1   19    2   16 o 52.19582 1.123475   35.72989   169.4   27.30551 1.172814          ?        ? 
1 1 1   19    2   17 f 8.724923 2.849711   8.184517   233.4  0.7518036 0.5713707          ?        ? 
1 1 1   19    2   18 o 20.50361 1.540009   21.33726   263.9   4.240172 0.6315150          ?        ? 
1 1 1   19    2   19 o 35.43593 1.060793   41.84473   177.5   12.63030 0.7518036          ?        ? 
1 1 1   19    2   20 o 30.56542 1.279020   30.17003    85.5   9.442654 0.7818757          ?        ? 
1 1 1   19    2   21 o 33.35601 1.307249   39.41905    47.1   11.30713 0.8720922          ?        ? 
1 1 1   19    3    0 o 63.98814 1.152247   73.33903   180.0   40.98833 1.473535   40.98833 1.473535 
1 1 1   19    3    1 o 105.8318 0.9803190   137.4565   164.7   112.0187 2.074978          ?        ? 
1 1 1   19    3    2 o 7.245246 2.933259   31.87540   215.0  0.2105050 0.6615872          ?        ? 
1 1 1   19    3    3 o 79.38662 0.9091349   76.88177    35.5   63.03122 1.443463          ?        ? 
1 1 1   19    3    4 o 103.8086 0.9125187   139.4355   224.2   107.7786 1.894545          ?        ? 
1 1 1   19    3    5 o 80.19644 0.8812054   77.85811     9.4   64.32432 1.413391          ?        ? 
1 1 1   19    3    6 o 170.2047 1.227942   228.7544   273.2   289.8053 4.180028          ?        ? 
1 1 1   19    3    7 o 196.7728 1.459496   269.3847   286.5   387.4195 5.743780          ?        ? 
1 1 1   19    3    8 o 161.0750 1.390890   184.4438   229.2   259.6128 4.480750          ?        ? 
1 1 1   19    3    9 o 64.57083 0.9547328   89.31776   185.5   41.71006 1.232958          ?        ? 
1 1 1   19    3   10 o 107.1589 1.164620   145.1970   182.4   114.9057 2.495988          ?        ? 
1 1 1   19    3   11 o 83.22740 1.083975   146.6495   247.4   69.31629 1.804329          ?        ? 
1 1 1   19    3   12 o 58.40269 1.081311   58.09910   237.0   34.13189 1.263030          ?        ? 
1 1 1   19    3   13 o 15.96198 3.814447   22.78036   211.7   2.676421 1.202886          ?        ? 
1 1 1   19    3   14 o 9.404842 3.535579   22.21955   355.2  0.6615872 0.9021643          ?        ? 
1 1 1   19    3   15 o 68.59081 1.161835   85.60351   350.7   47.12305 1.593824          ?        ? 
1 1 1   19    3   16 o 30.56890 1.475624   28.12174    62.5   9.382509 0.9021643          ?        ? 
1 1 1   19    3   17 o 47.91506 1.317989   65.47977   148.4   23.06533 1.263030          ?        ? 
1 1 1   19    3   18 o 21.51311 1.397852   24.94572   346.0   4.661182 0.6014429          ?        ? 
1 1 1   19    3   19 o 29.56933 1.220406   31.16147   128.6   8.811138 0.7217315          ?        ? 
1 1 1   19    3   20 o 7.067071 2.980881   8.264063   328.4  0.1202886 0.7217315          ?        ? 
1 1 1   19    3   21 o 33.57608 1.298681   36.20901   185.6   11.45749 0.8720922          ?        ? 
1 1 1   19    4    0 o 147.6644 1.660235   149.0933    -0.0   218.1734 4.901759   218.1734 4.901759 
1 1 1   19    4    1 o 152.9712 1.199181   132.0456   160.6   234.0515 3.668802          ?        ? 
1 1 1   19    4    2 o 107.1019 0.9686939   122.8292   226.3   114.7252 2.074978          ?        ? 
1 1 1   19    4    3 o 73.60934 0.8375010   117.3552   128.7   54.19000 1.232958          ?        ? 
1 1 1   19    4    4 o 40.25705 0.9337540   105.9817   116.0   16.20889 0.7518036          ?        ? 
1 1 1   19    4    5 o 191.3811 1.484900   228.8216   183.1   366.4291 5.683635          ?        ? 
1 1 1   19    4    6 o 74.31754 0.9104490   109.9791   250.1   55.24253 1.353247          ?        ? 
1 1 1   19    4    7 f 40.84637 1.104339   48.26878   132.8   16.69004 0.9021643          ?        ? 
1 1 1   19    4    8 o 96.04979 1.095812   96.09550    90.4   92.29141 2.105050          ?        ? 
1 1 1   19    4    9 o 91.82388 1.015244   112.9571    25.0   84.35236 1.864473          ?        ? 
1 1 1   19    4   10 o 26.44645 1.933063   34.26874    73.9   7.006810 1.022453          ?        ? 
1 1 1   19    4   11 o 57.51693 1.176390   79.45018   186.5   33.10943 1.353247          ?        ? 
1 1 1   19    4   12 o 102.3866 1.395130   123.0285    38.4   104.9518 2.856854          ?        ? 
1 1 1   19    4   13 o 40.67127 1.552730   43.25536   286.8   16.56975 1.263030          ?        ? 
1 1 1   19    4   14 o 71.50085 1.345870   72.24663   287.4   51.21286 1.924617          ?        ? 
1 1 1   19    4   15 f 42.88680 1.367337   44.67282   340.5   18.43423 1.172814          ?        ? 
1 1 1   19    4   16 o 58.83613 1.124457   70.60975    37.9   34.70325 1.323174          ?        ? 
1 1 1   19    4   17 o 28.87887 1.874376   39.19714   202.5   8.420200 1.082597          ?        ? 
1 1 1   19    4   18 o 42.98896 0.8044615   50.40899   198.7   18.52444 0.6916593          ?        ? 
1 1 1   19    4   19 o 12.98190 2.639873   12.49313    78.3   1.804329 0.6615872          ?        ? 
1 1 1   19    4   20 o 11.68388 3.054460   17.76005   342.1   1.503607 0.7217315          ?        ? 
1 1 1   19    4   21 o 10.48290 3.250953   15.63601   112.3   1.232958 0.7518036          ?        ? 
1 1 1   19    5    0 o 151.8564 1.713450   127.9142   180.0   230.7436 5.202481   230.7436 5.202481 
1 1 1   19    5    1 o 84.20308 0.8749889   141.8555    36.8   70.91012 1.473535          ?        ? 
1 1 1   19    5    2 o 264.9228 1.782152   377.0171   320.6   702.2147 9.442654          ?        ? 
1 1 1   19    5    3 o 5.358315 2.515746   53.41419   185.9 -0.7518036 0.6916593          ?        ? 
1 1 1   19    5    4 o 153.4145 1.313327   211.4308   132.9   235.4348 4.029667          ?        ? 
1 1 1   19    5    5 o 157.4447 1.279709   168.4104   181.0   247.9749 4.029667          ?        ? 
1 1 1   19    5    6 o 113.7374 1.084039   188.9968   233.4   129.4004 2.465916          ?        ? 
1 1 1   19    5    7 o 48.45408 1.086106   95.76376   263.9   23.48635 1.052525          ?        ? 
1 1 1   19    5    8 o 90.44031 1.080652   88.88458   237.9   81.82631 1.954689          ?        ? 
1 1 1   19    5    9 o 164.3113 1.409249   212.9619   274.5   270.1982 4.631110          ?        ? 
1 1 1   19    5   10 o 123.9645 1.261451   152.0128   330.6   153.7889 3.127503          ?        ? 
1 1 1   19    5   11 o 111.2173 1.243798   163.1045   341.9   123.8070 2.766637          ?        ? 
1 1 1   19    5   12 o 44.34831 1.559607   79.07838   133.1   19.69725 1.383319          ?        ? 
1 1 1   19    5   13 o 82.70838 1.163496   119.9650    98.8   68.47427 1.924617          ?        ? 
1 1 1   19    5   14 o 83.06360 1.285233   107.6946   115.4   69.10579 2.135122          ?        ? 
1 1 1   19    5   15 o 38.46231 1.837371   60.53405   114.7   14.85564 1.413391          ?        ? 
1 1 1   19    5   16 o 19.31621 2.724461   33.42395   302.5   3.789090 1.052525          ?        ? 
1 1 1   19    5   17 f 20.03051 2.627305   23.85272   144.8   4.089812 1.052525          ?        ? 
1 1 1   19    5   18 o 24.06662 2.186691   27.69959    38.6   5.894140 1.052525          ?        ? 
1 1 1   19    5   19 o 5.872670 2.567381   6.282974   254.8      -0.09 0.5713707          ?        ? 
1 1 1   19    5   20 o 37.96161 1.069433   37.70200   356.7   14.52485 0.8119479          ?        ? 
1 1 1   19    5   21 o 16.68060 2.163386   16.89937   178.6   2.916998 0.7217315          ?        ? 
1 1 1   19    6    0 o 91.36547 1.317178   85.26579   180.0   83.54041 2.405771   83.54041 2.405771 
1 1 1   19    6    1 o 141.0238 1.226139   152.5204   247.4   198.9272 3.458297          ?        ? 
1 1 1   19    6    2 o 145.6884 1.248806   244.2782    17.7   212.3093 3.638730          ?        ? 
1 1 1   19    6    3 o 241.8167 1.759683   279.1409    43.6   585.0836 8.510417          ?        ? 
1 1 1   19    6    4 o 134.0508 1.155320   203.4751    14.8   179.7412 3.097431          ?        ? 
1 1 1   19    6    5 o 25.06405 1.439775   42.68163   258.1   6.285078 0.7217315          ?        ? 
1 1 1   19    6    6 o 184.3965 1.467757   233.8263    10.5   340.2062 5.412986          ?        ? 
1 1 1   19    6    7 f 62.97015 1.002880   57.17406    21.5   39.66516 1.263030          ?        ? 
1 1 1   19    6    8 o 40.99028 1.173825   54.41753   197.3   16.81033 0.9623086          ?        ? 
1 1 1   19    6    9 o 170.2860 1.483422   224.1630   253.0   290.2263 5.052120          ?        ? 
1 1 1   19    6   10 o 32.65891 1.381192   52.60074   350.8   10.67561 0.9021643          ?        ? 
1 1 1   19    6   11 o 96.81169 1.133782   143.0970   271.8   93.79502 2.195267          ?        ? 
1 1 1   19    6   12 o 32.63977 1.796602   32.23769    12.0   10.67561 1.172814          ?        ? 
1 1 1   19    6   13 o 94.25216 1.148618   107.1326   298.6   88.92333 2.165194          ?        ? 
1 1 1   19    6   14 o 70.66248 1.489511   86.42142    10.5   50.04005 2.105050          ?        ? 
1 1 1   19    6   15 o 25.11190 2.874062   37.01534   187.7   6.375295 1.443463          ?        ? 
1 1 1   19    6   16 o 58.67572 1.435040   65.53413    46.2   34.58297 1.684040          ?        ? 
1 1 1   19    6   17 o 20.42054 2.429860   22.54308   205.2   4.240172 0.9923807          ?        ? 
1 1 1   19    6   18 o 35.64797 1.476276   38.39531    79.8   12.81073 1.052525          ?        ? 
1 1 1   19    6   19 o 15.54729 3.292245   19.50155   223.4   2.646349 0.9923807          ?        ? 
1 1 1   19    6   20 o 19.34143 1.710285   18.99169   143.5   3.819162 0.6615872          ?        ? 
1 1 1   19    6   21 o 18.54012 1.946405   27.79611    27.1   3.578585 0.7217315          ?        ? 
1 1 1   19    7    0 o 185.7247 2.202778   282.2397     0.0   345.2282 8.179624   345.2282 8.179624 
1 1 1   19    7    1 o 21.01976 1.716793   75.36349   219.7   4.420605 0.7217315          ?        ? 
1 1 1   19    7    2 o 53.89256 1.032303   58.09504   358.0   29.04969 1.112669          ?        ? 
1 1 1   19    7    3 o 84.28880 1.052487   74.39799   124.1   71.06048 1.774257          ?        ? 
1 1 1   19    7    4 o 77.73885 0.9864305   124.5073    61.3   60.44501 1.533679          ?        ? 
1 1 1   19    7    5 o 121.0356 1.118057   143.0625    41.3   146.5416 2.706493          ?        ? 
1 1 1   19    7    6 o 141.6573 1.103897   139.7731   277.5   200.7316 3.127503          ?        ? 
1 1 1   19    7    7 o 150.0293 1.443181   200.4007   138.5   225.2404 4.330389          ?        ? 
1 1 1   19    7    8 o 94.21263 1.101221   125.7974   241.2   88.80304 2.074978          ?        ? 
1 1 1   19    7    9 o 62.65129 1.175981   34.99203    57.7   39.27422 1.473535          ?        ? 
1 1 1   19    7   10 o 83.91523 1.110926   103.8836    47.7   70.45904 1.864473          ?        ? 
1 1 1   19    7   11 o 49.93177 1.415322   41.71934   238.5   24.95988 1.413391          ?        ? 
1 1 1   19    7   12 o 32.86297 1.921661   19.91245   301.6   10.82597 1.263030          ?        ? 
1 1 1   19    7   13 o 22.67357 2.785247   25.05962   336.4   5.172409 1.263030          ?        ? 
1 1 1   19    7   14 o 49.67915 1.664650   72.77151   297.3   24.74938 1.653968          ?        ? 
1 1 1   19    7   15 o 63.79614 1.531981   85.22663   336.7   40.83797 1.954689          ?        ? 
1 1 1   19    7   16 o 54.00904 1.670395   60.92246   243.8   29.35041 1.804329          ?        ? 
1 1 1   19    7   17 f 14.54913 4.075856   13.57076   327.7   2.285483 1.232958          ?        ? 
1 1 1   19    7   18 o 41.08824 1.463784   46.13324   231.4   17.02083 1.202886          ?        ? 
1 1 1   19    7   19 o 14.99508 3.803135   18.35099   254.1   2.526060 1.142741          ?        ? 
1 1 1   19    7   20 o 23.36392 1.351475   32.59025   334.3   5.533275 0.6315150          ?        ? 
1 1 1   19    7   21 o 7.104452 2.952781   4.639419    68.2  0.2405772 0.6916593          ?        ? 
1 1 1   19    8    0 o 22.90769 2.341374   38.98236   180.0   5.412986 1.052525   5.412986 1.052525 
1 1 1   19    8    1 o 76.74590 1.057969   68.68177    36.5   58.91133 1.623896          ?        ? 
1 1 1   19    8    2 o 162.9662 1.485466   222.3678   109.5   265.6874 4.841615          ?        ? 
1 1 1   19    8    3 o 60.04166 0.9766666   48.58512   228.9   36.05650 1.172814          ?        ? 
1 1 1   19    8    4 o 33.12419 1.316398   15.96609   325.7   10.97633 0.8720922          ?        ? 
1 1 1   19    8    5 o 183.5079 1.556801   194.1852   207.6   336.9584 5.713707          ?        ? 
1 1 1   19    8    6 o 83.58968 0.8814098   92.82456   198.4   69.88766 1.473535          ?        ? 
1 1 1   19    8    7 o 112.4573 1.377159   141.6518   310.2   126.5436 3.097431          ?        ? 
1 1 1   19    8    8 o 189.3554 1.762827   241.5320   313.7   359.0313 6.676016          ?        ? 
1 1 1   19    8    9 o 23.30656 2.128973   32.39533    93.0   5.443058 0.9923807          ?        ? 
1 1 1   19    8   10 o 72.99229 1.194773   101.1795   177.2   53.31791 1.744184          ?        ? 
1 1 1   19    8   11 f 38.59246 1.636369   55.03103   300.1   14.91578 1.263030          ?        ? 
1 1 1   19    8   12 o 137.9821 1.612773   172.7201   326.4   190.7175 4.450677          ?        ? 
1 1 1   19    8   13 o 47.35034 1.524237   56.66809    51.8   22.46389 1.443463          ?        ? 
1 1 1   19    8   14 o 118.3248 1.613848   153.7619   157.4   140.4068 3.819162          ?        ? 
1 1 1   19    8   15 o 16.49001 3.811872   13.37120   166.4   2.886926 1.232958          ?        ? 
1 1 1   19    8   16 o 30.12627 2.495509   36.11486   299.8   9.202076 1.503607          ?        ? 
1 1 1   19    8   17 o 11.86290 4.264793   19.16014   166.1   1.293102 1.293102          ?        ? 
1 1 1   19    8   18 o 14.53814 3.710336   33.70141   223.0   2.315555 1.082597          ?        ? 
1 1 1   19    8   19 o 26.76570 2.303242   31.58282   245.0   7.397748 1.232958          ?        ? 
1 1 1   19    8   20 o 25.22130 2.503895   24.04934   130.3   6.676016 1.263030          ?        ? 
1 1 1   19    8   21 o 5.476911 2.537402   8.299878   336.5 -0.4510822 0.6615872          ?        ? 
1 1 1   19    9    0 o 72.19436 1.563674   31.68307   360.0   52.20525 2.255411   52.20525 2.255411 
1 1 1   19    9    1 o 30.32954 1.388119   44.27016   189.6   9.202076 0.8420200          ?        ? 
1 1 1   19    9    2 o 56.34689 1.040708   27.71551    66.0   31.75618 1.172814          ?        ? 
1 1 1   19    9    3 o 137.7405 1.244450   147.7499   317.9   189.7853 3.428224          ?        ? 
1 1 1   19    9    4 o 202.7337 1.683583   243.3771   334.8   411.2967 6.826377          ?        ? 
1 1 1   19    9    5 o 91.57069 0.9523705   120.5390    16.2   83.87121 1.744184          ?        ? 
1 1 1   19    9    6 o 30.28014 1.042787   62.53426    36.6   9.172004 0.6315150          ?        ? 
1 1 1   19    9    7 o 51.92503 1.187248   50.57175    21.8   26.97471 1.232958          ?        ? 
1 1 1   19    9    8 o 27.72300 2.006762   33.48757   289.7   7.698469 1.112669          ?        ? 
1 1 1   19    9    9 o 26.33251 1.941427   14.76797    23.2   6.946666 1.022453          ?        ? 
1 1 1   19    9   10 o 32.51341 1.526110   36.50171   114.2   10.58539 0.9923807          ?        ? 
1 1 1   19    9   11 o 104.6320 1.307710   129.2259   259.2   109.5829 2.736565          ?        ? 
1 1 1   19    9   12 o 87.11993 1.363465   118.2274    20.9   75.99231 2.375700          ?        ? 
1 1 1   19    9   13 o 60.85993 1.457656   95.84341    54.1   37.10903 1.774257          ?        ? 
1 1 1   19    9   14 o 29.82236 2.520939   46.16591    84.9   8.961499 1.503607          ?        ? 
1 1 1   19    9   15 o 60.23650 1.547627   72.78882   237.7   36.41737 1.864473          ?        ? 
1 1 1   19    9   16 o 14.55175 4.206017   26.99458   141.4   2.255411 1.293102          ?        ? 
1 1 1   19    9   17 o 46.79615 1.606550   63.96235    74.5   22.07295 1.503607          ?        ? 
1 1 1   19    9   18 o 26.51168 2.438741   34.01753   154.3   7.217315 1.293102          ?        ? 
1 1 1   19    9   19 o 13.95303 3.784173   16.35855   105.0   2.195267 1.082597          ?        ? 
1 1 1   19    9   20 o 14.89467 3.489707   12.52835   221.1   2.526060 1.022453          ?        ? 
1 1 1   19    9   21 o 20.92844 1.580594   22.90821    81.5   4.510822 0.6615872          ?        ? 
1 1 1   19   10    0 o 170.9474 2.323034   232.6759    -0.0   292.5418 7.939046   292.5418 7.939046 
1 1 1   19   10    1 o 75.36298 0.9776253   83.89191   302.1   56.80628 1.473535          ?        ? 
1 1 1   19   10    2 o 49.19554 1.100300   84.71201   133.8   24.20808 1.082597          ?        ? 
1 1 1   19   10    3 o 65.24741 0.9909223   54.16138   167.5   42.58216 1.293102          ?        ? 
1 1 1   19   10    4 o 118.2165 1.233752   150.1174   279.1   139.8054 2.916998          ?        ? 
1 1 1   19   10    5 o 45.64592 0.8893981   19.60158   246.2   20.84000 0.8119479          ?        ? 
1 1 1   19   10    6 o 90.21165 0.9500503   125.5740   268.3   81.40530 1.714112          ?        ? 
1 1 1   19   10    7 o 71.34403 0.8008669   97.27271   154.5   50.91214 1.142741          ?        ? 
1 1 1   19   10    8 o 30.21848 1.691768   52.14379   351.7   9.141932 1.022453          ?        ? 
1 1 1   19   10    9 o 195.2338 1.779063   224.5832   354.8   381.7358 6.946666          ?        ? 
1 1 1   19   10   10 o 105.8569 1.292577   145.5300   316.1   112.1691 2.736565          ?        ? 
1 1 1   19   10   11 o 57.61968 1.226483   92.07628   313.4   33.22972 1.413391          ?        ? 
1 1 1   19   10   12 o 126.1395 1.573465   121.1948   246.4   159.3824 3.969523          ?        ? 
1 1 1   19   10   13 o 16.19871 4.225906   25.65718   123.5   2.766637 1.383319          ?        ? 
1 1 1   19   10   14 o 54.31791 1.550170   63.36431   296.4   29.59099 1.684040          ?        ? 
1 1 1   19   10   15 o 59.65316 1.411526   77.63529    58.4   35.69564 1.684040          ?        ? 
1 1 1   19   10   16 o 38.86943 1.740760   44.17297   169.9   15.21651 1.353247          ?        ? 
1 1 1   19   10   17 o 24.85654 2.601131   32.55445   334.3   6.315150 1.293102          ?        ? 
1 1 1   19   10   18 o 10.41129 4.112453   12.40020    33.2  0.7818757 1.263030          ?        ? 
1 1 1   19   10   19 f 11.03540 4.052228   3.481782    16.3   1.172814 1.172814          ?        ? 
1 1 1   19   10   20 f 13.20905 4.175921   18.92159   324.3   2.044906 1.232958          ?        ? 
1 1 1   19   10   21 o 18.54217 1.621825   23.75216   325.5   3.548513 0.6014429          ?        ? 
1 1 1   19   11    0 o 137.8944 2.029137   63.79781   360.0   190.3567 5.593419   190.3567 5.593419 
1 1 1   19   11    1 o 108.6675 1.189963   120.5604   354.9   118.1234 2.586205          ?        ? 
1 1 1   19   11    2 o 94.38108 1.099255   91.54407    65.8   89.10376 2.074978          ?        ? 
1 1 1   19   11    3 o 274.7455 2.123418   356.6852   182.6   755.7130 11.66799          ?        ? 
1 1 1   19   11    4 o 146.8404 1.249248   170.7545   179.8   215.7075 3.668802          ?        ? 
1 1 1   19   11    5 o 58.23507 0.8778671   70.30469   133.5   33.92138 1.022453          ?        ? 
1 1 1   19   11    6 o 72.92745 0.8865677   85.13203    56.3   53.19762 1.293102          ?        ? 
1 1 1   19   11    7 o 82.13322 0.8970397   104.2853   272.8   67.48189 1.473535          ?        ? 
1 1 1   19   11    8 o 54.04497 1.307606   40.31191    26.2   29.23012 1.413391          ?        ? 
1 1 1   19   11    9 o 53.03275 1.304212   83.98834   314.5   28.14753 1.383319          ?        ? 
1 1 1   19   11   10 o 46.24894 1.332958   61.56892    35.7   21.41137 1.232958          ?        ? 
1 1 1   19   11   11 o 76.28633 1.202313   118.8782   113.2   58.24974 1.834401          ?        ? 
1 1 1   19   11   12 o 44.06458 1.672018   79.30288    82.0   19.45668 1.473535          ?        ? 
1 1 1   19   11   13 o 91.66750 1.459853   90.98713   248.5   84.20200 2.676421          ?        ? 
1 1 1   19   11   14 o 7.955914 3.737647   19.87831    36.7  -1.623896 1.533679          ?        ? 
1 1 1   19   11   15 o 44.07219 1.637612   54.00827   321.8   19.51682 1.443463          ?        ? 
1 1 1   19   11   16 o 8.310672 3.770259   10.60227    11.5 -0.6916593 1.353247          ?        ? 
1 1 1   19   11   17 o 13.90388 4.313080   12.49371   259.6   2.074978 1.323174          ?        ? 
1 1 1   19   11   18 o 14.30081 4.229541   3.550203   284.7   2.285483 1.293102          ?        ? 
1 1 1   19   11   19 o 9.260089 3.951194   9.525927   129.0  0.2105050 1.293102          ?        ? 
1 1 1   19   11   20 o 35.50946 1.990161   45.59195   204.8   13.05131 1.413391          ?        ? 
1 1 1   19   11   21 o 17.64871 1.618732   30.24798   210.7   3.217719 0.5713707          ?        ? 
1 1 1   19   12    0 o 48.26205 1.498623   68.38178   180.0   23.36606 1.443463   23.36606 1.443463 
1 1 1   19   12    1 o 38.72910 1.320006   56.95281     1.5   15.00600 1.022453          ?        ? 
1 1 1   19   12    2 o 187.0632 1.623669   256.1132   352.9   350.1601 6.074574          ?        ? 
1 1 1   19   12    3 o 61.79075 1.046356   98.38803   109.5   38.19162 1.293102          ?        ? 
1 1 1   19   12    4 o 86.45111 0.9913766   154.5231   125.0   74.75935 1.714112          ?        ? 
1 1 1   19   12    5 o 81.45605 0.9229561   94.61369   252.3   66.36922 1.503607          ?        ? 
1 1 1   19   12    6 o 48.23833 0.8727707   59.28162   322.2   23.27584 0.8420200          ?        ? 
1 1 1   19   12    7 o 104.8906 0.9891151   112.1889   329.4   110.0640 2.074978          ?        ? 
1 1 1   19   12    8 o 70.54446 1.193602   69.92405   213.6   49.79947 1.684040          ?        ? 
1 1 1   19   12    9 o 127.8668 1.434619   144.4004   249.1   163.6827 3.668802          ?        ? 
1 1 1   19   12   10 o 25.27507 2.201120   39.81101    78.9   6.405366 1.112669          ?        ? 
1 1 1   19   12   11 o 36.79491 1.634582   47.69408   220.5   13.56254 1.202886          ?        ? 
1 1 1   19   12   12 o 47.37674 1.650337   76.74607   182.9   22.49397 1.563751          ?        ? 
1 1 1   19   12   13 o 52.36012 1.608132   50.27336   171.6   27.48594 1.684040          ?        ? 
1 1 1   19   12   14 o 54.46175 1.435642   53.61782   119.4   29.74135 1.563751          ?        ? 
1 1 1   19   12   15 o 34.32451 1.971254   34.55674   113.4   11.87850 1.353247          ?        ? 
1 1 1   19   12   16 o 11.22735 4.230461   19.38062   316.5   1.022453 1.293102          ?        ? 
1 1 1   19   12   17 o 9.574389 4.086047   16.12614    11.7  0.1202886 1.383319          ?        ? 
1 1 1   19   12   18 o 13.00697 4.522484   17.98963   116.4   1.774257 1.443463          ?        ? 
1 1 1   19   12   19 o 15.66604 3.936723   26.68034   112.6   2.796710 1.232958          ?        ? 
1 1 1   19   12   20 o 15.07148 4.410619   23.64889   179.0   2.766637 1.413391          ?        ? 
1 1 1   19   12   21 o 20.20861 1.339277   25.04717   255.9   4.180028 0.5412986          ?        ? 
1 1 1   19   13    0 o 5.758318 3.923802   23.77657   360.0 -0.6315150 1.323174 -0.6315150 1.323174 
1 1 1   19   13    1 o 33.84078 1.377386   44.08044    52.1   11.45749 0.9322364          ?        ? 
1 1 1   19   13    2 o 74.37492 1.071479   73.60867   132.2   55.33274 1.593824          ?        ? 
1 1 1   19   13    3 o 165.3673 1.436620   195.5588   127.5   273.6265 4.751399          ?        ? 
1 1 1   19   13    4 o 170.3159 1.386050   242.8759   137.3   290.2563 4.721327          ?        ? 
1 1 1   19   13    5 o 100.6821 1.015526   123.6609   303.5   101.4033 2.044906          ?        ? 
1 1 1   19   13    6 o 59.65978 0.9073091   89.53967   291.7   35.60542 1.082597          ?        ? 
1 1 1   19   13    7 f 18.82950 1.437368   29.07326   132.4   3.548513 0.5412986          ?        ? 
1 1 1   19   13    8 o 123.0826 1.184975   142.8312   140.2   151.5937 2.916998          ?        ? 
1 1 1   19   13    9 o 37.36102 1.730550   63.44966    67.9   13.98355 1.293102          ?        ? 
1 1 1   19   13   10 o 27.49646 2.023295   43.86869   162.3   7.578181 1.112669          ?        ? 
1 1 1   19   13   11 o 42.30125 1.563990   61.99184   201.9   17.92300 1.323174          ?        ? 
1 1 1   19   13   12 o 60.82430 1.285466   77.92148   192.0   37.04888 1.563751          ?        ? 
1 1 1   19   13   13 f 22.82874 2.963910   41.64706   158.6   5.262625 1.353247          ?        ? 
1 1 1   19   13   14 o 16.65697 3.863067   26.71650    61.1   2.947070 1.263030          ?        ? 
1 1 1   19   13   15 o 28.02379 2.575425   40.73724   152.2   7.969118 1.443463          ?        ? 
1 1 1   19   13   16 o 45.84541 1.738259   46.87581   195.2   21.20086 1.593824          ?        ? 
1 1 1   19   13   17 o 19.66107 3.729506   19.27306   228.6   4.180028 1.413391          ?        ? 
1 1 1   19   13   18 o 8.155662 3.674124   14.93227   218.7 -0.4510822 1.263030          ?        ? 
1 1 1   19   13   19 f 8.900299 3.936610   9.007394   229.1 -0.1503607 1.383319          ?        ? 
1 1 1   19   13   20 o 19.67102 3.883689   23.90293   190.9   4.540894 1.473535          ?        ? 
1 1 1   19   14    0 o 80.54707 1.662981   95.72419     0.0   64.98591 2.676421   64.98591 2.676421 
1 1 1   19   14    1 o 56.36931 1.120317   41.38322   159.2   31.78626 1.263030          ?        ? 
1 1 1   19   14    2 o 75.17633 1.100059   76.50377    74.2   56.53563 1.653968          ?        ? 
1 1 1   19   14    3 o 26.91174 1.452667   11.33434   357.9   7.247387 0.7818757          ?        ? 
1 1 1   19   14    4 o 86.57096 1.007373   83.81935   308.6   74.96986 1.744184          ?        ? 
1 1 1   19   14    5 f 88.03165 0.9906576   116.0883    55.9   77.52599 1.744184          ?        ? 
1 1 1   19   14    6 o 26.96786 1.282377   38.99971     7.3   7.277459 0.6916593          ?        ? 
1 1 1   19   14    7 o 47.95359 0.9406641   54.89902   194.5   23.00519 0.9021643          ?        ? 
1 1 1   19   14    8 o 4.431764 2.125890   37.13296   267.7 -0.7818757 0.5412986          ?        ? 
1 1 1   19   14    9 o 106.0302 1.091932   135.4905   259.2   112.4999 2.315555          ?        ? 
1 1 1   19   14   10 f 83.75602 1.238704   105.1992   127.4   70.21846 2.074978          ?        ? 
1 1 1   19   14   11 o 57.94753 1.323335   72.37740   114.7   33.62066 1.533679          ?        ? 
1 1 1   19   14   12 o 23.33878 2.254884   33.37162   242.5   5.473131 1.052525          ?        ? 
1 1 1   19   14   13 f 15.08663 4.409199   26.30474   201.3   2.375700 1.413391          ?        ? 
1 1 1   19   14   14 o 32.86827 2.241577   53.45381   142.8   10.88612 1.473535          ?        ? 
1 1 1   19   14   15 o 54.86209 1.644422   65.61542   230.7   30.28265 1.804329          ?        ? 
1 1 1   19   14   16 o 43.31878 1.631383   54.82750    71.2   18.91538 1.413391          ?        ? 
1 1 1   19   14   17 o 25.71567 2.806583   31.29425    87.6   6.826377 1.443463          ?        ? 
1 1 1   19   14   18 o 14.93689 4.360951   17.34033   347.7   2.556132 1.383319          ?        ? 
1 1 1   19   14   19 o 35.56044 2.071874   30.82348   356.2   13.05131 1.473535          ?        ? 
1 1 1   19   14   20 o 14.64252 4.440837   24.84463    35.2   2.706493 1.413391          ?        ? 
1 1 1   19   15    0 o 52.74049 1.628461   74.76247    -0.0   27.90695 1.714112   27.90695 1.714112 
1 1 1   19   15    1 o 189.4624 1.634853   206.6065   280.1   359.2719 6.194862          ?        ? 
1 1 1   19   15    2 o 90.75766 1.027171   142.1614   213.9   82.39767 1.864473          ?        ? 
1 1 1   19   15    3 o 164.5274 1.379981   199.2557   334.0   270.8598 4.540894          ?        ? 
1 1 1   19   15    4 o 190.1181 1.518491   233.0361   358.8   361.7679 5.773852          ?        ? 
1 1 1   19   15    5 o 51.13948 0.9702688   37.35279   246.8   26.16277 0.9923807          ?        ? 
1 1 1   19   15    6 o 25.76707 1.517200   50.93248   352.8   6.645944 0.7818757          ?        ? 
1 1 1   19   15    7 o 107.3616 1.064386   154.9641   338.4   115.3267 2.285483          ?        ? 
1 1 1   19   15    8 o 16.43506 1.829756   12.23072   119.2   2.706493 0.6014429          ?        ? 
1 1 1   19   15    9 o 42.46744 0.9205591   71.19981    71.6   18.04329 0.7818757          ?        ? 
1 1 1   19   15   10 o 99.39401 1.331242   114.9014   354.5   98.90728 2.646349          ?        ? 
1 1 1   19   15   11 o 71.80972 1.298204   87.26873   193.4   51.63387 1.864473          ?        ? 
1 1 1   19   15   12 o 44.60209 1.517021   78.03425   235.1   19.93783 1.353247          ?        ? 
1 1 1   19   15   13 o 42.83931 1.930433   54.64451   354.3   18.43423 1.653968          ?        ? 
1 1 1   19   15   14 o 66.95773 1.549469   77.17770   185.6   45.01800 2.074978          ?        ? 
1 1 1   19   15   15 f 10.84078 4.328740   18.55507   123.0  0.6916593 1.413391          ?        ? 
1 1 1   19   15   16 o 18.90835 3.710699   18.84488   353.9   3.849235 1.353247          ?        ? 
1 1 1   19   15   17 o 40.69537 1.773498   54.49300   183.3   16.81033 1.443463          ?        ? 
1 1 1   19   15   18 o 14.64118 4.440918   16.64883    86.3   2.465916 1.413391          ?        ? 
1 1 1   19   15   19 o 9.860191 4.189902   5.921192   255.6  0.4210100 1.443463          ?        ? 
1 1 1   19   15   20 o 9.700301 4.157926   16.83486   104.4  0.5112265 1.443463          ?        ? 
1 1 1   19   16    0 o 153.2637 1.982483   207.8618   180.0   235.1642 6.074574   235.1642 6.074574 
1 1 1   19   16    1 o 48.45119 1.210304   129.9797   181.1   23.48635 1.172814          ?        ? 
1 1 1   19   16    2 o 132.1946 1.194291   159.7025   225.7   174.8395 3.157575          ?        ? 
1 1 1   19   16    3 o 116.7808 1.287546   146.4763   310.5   136.4674 3.007215          ?        ? 
1 1 1   19   16    4 o 126.8257 1.375261   154.2761   338.8   160.9762 3.488369          ?        ? 
1 1 1   19   16    5 o 81.02068 1.132057   123.8185   106.2   65.67756 1.834401          ?        ? 
1 1 1   19   16    6 o 165.0576 1.466644   198.5176    81.8   272.7243 4.841615          ?        ? 
1 1 1   19   16    7 o 92.67644 1.135699   109.1477    97.0   85.94618 2.105050          ?        ? 
1 1 1   19   16    8 o 49.66844 1.180643   49.47409   126.7   24.68923 1.172814          ?        ? 
1 1 1   19   16    9 f 72.91148 1.072363   78.19965    26.8   53.19762 1.563751          ?        ? 
1 1 1   19   16   10 o 67.11421 1.075378   90.04359   219.2   45.07814 1.443463          ?        ? 
1 1 1   19   16   11 o 54.48888 1.407332   64.70629    44.6   29.74135 1.533679          ?        ? 
1 1 1   19   16   12 o 32.04359 2.064647   42.84868   320.7   10.31474 1.323174          ?        ? 
1 1 1   19   16   13 o 15.83386 4.522200   19.05187   232.2   2.646349 1.503607          ?        ? 
1 1 1   19   16   14 o 36.92865 2.157977   35.88458   309.8   13.77304 1.593824          ?        ? 
1 1 1   19   16   15 o 25.56125 2.823537   41.34752   147.7   6.676016 1.443463          ?        ? 
1 1 1   19   16   16 o 20.37104 3.173874   30.98734   100.1   4.300317 1.293102          ?        ? 
1 1 1   19   16   17 o 36.33230 2.110628   32.62643   326.2   13.50239 1.533679          ?        ? 
1 1 1   19   16   18 o 9.580400 4.155293   19.61597   228.2       0.09 1.473535          ?        ? 
1 1 1   19   16   19 o 10.62749 4.321193   14.36290    49.0  0.8720922 1.443463          ?        ? 
1 1 1   19   16   20 o 9.483419 3.202801   13.59697   244.3  0.9923807 0.7217315          ?        ? 
1 1 1   19   17    0 o 44.13569 2.712538   92.46902   180.0   19.72733 2.375700   19.72733 2.375700 
1 1 1   19   17    1 o 57.73479 1.119864   89.11681   105.0   33.35001 1.293102          ?        ? 
1 1 1   19   17    2 o 43.33887 1.248991   53.95560   210.7   18.79509 1.082597          ?        ? 
1 1 1   19   17    3 o 136.8764 1.384128   174.8425   204.2   187.4998 3.789090          ?        ? 
1 1 1   19   17    4 o 64.02635 1.221178   88.80580   280.3   41.01840 1.563751          ?        ? 
1 1 1   19   17    5 o 128.0468 1.350404   159.7614     4.4   164.1037 3.458297          ?        ? 
1 1 1   19   17    6 o 53.48637 1.236927   61.85330   126.8   28.62868 1.323174          ?        ? 
1 1 1   19   17    7 o 100.1630 1.185917   141.0917    92.8   100.4109 2.375700          ?        ? 
1 1 1   19   17    8 o 103.9372 1.157320   128.9852   236.9   108.1094 2.405771          ?        ? 
1 1 1   19   17    9 o 74.55980 1.068823   96.47973   163.7   55.63347 1.593824          ?        ? 
1 1 1   19   17   10 o 29.85863 1.561084   47.11281   172.7   8.931427 0.9322364          ?        ? 
1 1 1   19   17   11 o 6.954011 2.959069   9.953519    89.4   0.000000 0.7217315          ?        ? 
1 1 1   19   17   12 o 42.82858 1.650056   58.54804    15.5   18.40415 1.413391          ?        ? 
1 1 1   19   17   13 o 36.00409 1.712247   51.65744   100.6   13.02124 1.232958          ?        ? 
1 1 1   19   17   14 o 17.12630 3.623191   18.54034   296.6   3.127503 1.202886          ?        ? 
1 1 1   19   17   15 o 15.52555 4.032277   13.11515   316.8   2.616277 1.263030          ?        ? 
1 1 1   19   17   16 o 39.96176 1.881308   34.87472   246.3   16.17881 1.503607          ?        ? 
1 1 1   19   17   17 o 10.73075 4.283184   9.691277    13.9  0.8119479 1.383319          ?        ? 
1 1 1   19   17   18 o 16.67007 1.623564   16.64948   177.8   2.826782 0.5412986          ?        ? 
1 1 1   19   17   19 o 16.69434 1.981472   13.20971   192.0   2.886926 0.6615872          ?        ? 
1 1 1   19   17   20 o 7.685920 3.197155   12.56709   123.3  0.3307936 0.8119479          ?        ? 
1 1 1   19   18    0 o 198.6410 2.483657   218.5395     0.0   395.2683 9.863664   395.2683 9.863664 
1 1 1   19   18    1 f 103.7748 1.405446   124.8826   104.4   107.7786 2.916998          ?        ? 
1 1 1   19   18    2 o 188.6686 1.912696   250.7176    63.0   356.4752 7.217315          ?        ? 
1 1 1   19   18    3 o 132.4697 1.373420   163.4743   265.5   175.6213 3.638730          ?        ? 
1 1 1   19   18    4 o 87.43829 1.152146   88.48969   282.9   76.50353 2.014834          ?        ? 
1 1 1   19   18    5 o 84.62688 1.154887   103.3497   343.0   71.66192 1.954689          ?        ? 
1 1 1   19   18    6 o 88.76384 1.134941   104.1702     9.3   78.84917 2.014834          ?        ? 
1 1 1   19   18    7 o 50.14997 1.199289   68.26498    23.2   25.17038 1.202886          ?        ? 
1 1 1   19   18    8 o 33.82245 1.600412   40.05549   127.2   11.45749 1.082597          ?        ? 
1 1 1   19   18    9 o 59.11405 1.119171   58.89092   114.1   34.97390 1.323174          ?        ? 
1 1 1   19   18   10 o 29.08795 1.654137   32.37466   122.0   8.480345 0.9623086          ?        ? 
1 1 1   19   18   11 o 44.21134 1.258353   20.74030   343.5   19.57697 1.112669          ?        ? 
1 1 1   19   18   12 o 47.13987 1.084489   47.20706   212.5   22.25339 1.022453          ?        ? 
1 1 1   19   18   13 o 50.30598 1.016234   64.19749   204.7   25.35082 1.022453          ?        ? 
1 1 1   19   18   14 o 53.86578 1.646924   63.82140   242.7   29.20005 1.774257          ?        ? 
1 1 1   19   18   15 o 12.38128 4.282809   15.95292   195.1   1.503607 1.293102          ?        ? 
1 1 1   19   18   16 o 43.30133 1.805662   55.14382   229.3   19.00560 1.563751          ?        ? 
1 1 1   19   18   17 o 17.24168 1.918569   21.72349    77.2   3.037287 0.6615872          ?        ? 
1 1 1   19   18   18 o 19.85879 1.741444   29.72170    54.0   4.029667 0.6916593          ?        ? 
1 1 1   19   18   19 o 6.739087 2.945582   4.197688   337.6      -0.03 0.7518036          ?        ? 
1 1 1   19   19    0 o 76.64780 1.551167   86.20799   180.0   58.85118 2.375700   58.85118 2.375700 
1 1 1   19   19    1 o 79.44318 1.192390   124.5667   105.8   63.15150 1.894545          ?        ? 
1 1 1   19   19    2 o 178.3845 1.820669   167.6807   221.0   318.7046 6.495584          ?        ? 
1 1 1   19   19    3 o 18.63706 2.985099   14.21648   211.8   3.488369 1.112669          ?        ? 
1 1 1   19   19    4 o 41.67293 1.371084   51.39138   290.1   17.38170 1.142741          ?        ? 
1 1 1   19   19    5 o 76.21241 1.183750   77.24209   251.7   58.12946 1.804329          ?        ? 
1 1 1   19   19    6 o 119.3780 1.360298   119.3722   236.3   142.6622 3.247792          ?        ? 
1 1 1   19   19    7 o 113.9004 1.267303   137.5243   185.6   129.8515 2.886926          ?        ? 
1 1 1   19   19    8 o 25.74424 2.044195   10.95489     3.3   6.645944 1.052525          ?        ? 
1 1 1   19   19    9 o 9.051608 3.653950   20.87946    40.5  0.3608657 1.022453          ?        ? 
1 1 1   19   19   10 o 32.44159 1.761230   40.98172    44.6   10.55532 1.142741          ?        ? 
1 1 1   19   19   11 o 25.78145 1.924602   30.95156   212.8   6.676016 0.9923807          ?        ? 
1 1 1   19   19   12 o 85.56356 1.107098   112.8978    67.0   73.34596 1.894545          ?        ? 
1 1 1   19   19   13 o 96.53458 1.168188   117.8511   179.7   93.46423 2.255411          ?        ? 
1 1 1   19   19   14 o 14.45245 2.701172   16.70747   316.8   2.195267 0.7518036          ?        ? 
1 1 1   19   19   15 o 18.22805 1.979728   23.07006    32.0   3.368080 0.7217315          ?        ? 
1 1 1   19   19   16 o 11.06882 3.034882   15.61090   330.9   1.323174 0.6916593          ?        ? 
1 1 1   19   19   17 f 41.44460 1.160958   47.06815   333.3   17.32155 0.9623086          ?        ? 
1 1 1   19   19   18 o 12.03119 3.194907   5.164574   233.0   1.623896 0.7818757          ?        ? 
1 1 1   19   19   19 o 19.74254 2.056341   16.89100    48.8   4.089812 0.8119479          ?        ? 
1 1 1   19   20    0 o 19.79336 3.603272   20.74838   180.0   4.270245 1.293102   4.270245 1.293102 
1 1 1   19   20    1 o 94.88790 1.172615   128.0683   181.0   90.09615 2.225339          ?        ? 
1 1 1   19   20    2 o 187.0801 1.848565   224.9807   252.8   350.5510 6.916593          ?        ? 
1 1 1   19   20    3 o 13.50218 3.684555   10.25704   211.9   1.894545 1.022453          ?        ? 
1 1 1   19   20    4 o 74.10193 1.379793   93.95458    51.3   54.97188 2.044906          ?        ? 
1 1 1   19   20    5 o 100.6577 1.195026   126.3898   284.5   101.4033 2.405771          ?        ? 
1 1 1   19   20    6 o 38.40338 1.448661   36.60427   273.0   14.76542 1.112669          ?        ? 
1 1 1   19   20    7 o 17.80904 2.786172   31.32141   266.8   3.187647 0.9923807          ?        ? 
1 1 1   19   20    8 o 27.49002 2.023770   29.30300   318.5   7.578181 1.112669          ?        ? 
1 1 1   19   20    9 o 39.43134 1.487159   57.65991    19.9   15.57737 1.172814          ?        ? 
1 1 1   19   20   10 o 32.39066 1.810419   60.25806   108.2   10.52525 1.172814          ?        ? 
1 1 1   19   20   11 o 32.85239 1.601900   51.06232   267.0   10.82597 1.052525          ?        ? 
1 1 1   19   20   12 o 68.66801 1.116735   87.33887    63.2   47.24334 1.533679          ?        ? 
1 1 1   19   20   13 o 36.79313 1.348595   63.88421   114.3   13.59261 0.9923807          ?        ? 
1 1 1   19   20   14 o 15.84895 2.466649   18.54675   221.8   2.556132 0.7818757          ?        ? 
1 1 1   19   20   15 o 25.53220 1.236703   34.69896   308.4   6.555727 0.6315150          ?        ? 
1 1 1   19   20   16 o 18.29334 1.726079   23.35564   130.5   3.398152 0.6315150          ?        ? 
1 1 1   19   20   17 o 31.19042 1.108769   43.28023    87.8   9.803518 0.6916593          ?        ? 
1 1 1   19   20   18 o 12.78252 3.088402   17.91446    83.0   1.834401 0.7818757          ?        ? 
1 1 1   19   20   19 o 6.689151 3.007423   15.30993   123.4 -0.2105050 0.8420200          ?        ? 
1 1 1   19   21    0 o 49.05933 1.968393   1.780360   360.0   24.20808 1.924617   24.20808 1.924617 
1 1 1   19   21    1 o 40.16402 1.422594   45.36380   137.8   16.14874 1.142741          ?        ? 
1 1 1   19   21    2 o 37.36837 1.569260   42.05960   344.9   13.98355 1.172814          ?        ? 
1 1 1   19   21    3 o 208.0569 2.052440   245.1194   358.8   433.9711 8.540489          ?        ? 
1 1 1   19   21    4 o 46.33796 1.557538   69.24648   352.4   21.50158 1.443463          ?        ? 
1 1 1   19   21    5 o 38.86262 1.663684   72.82935    95.8   15.12629 1.293102          ?        ? 
1 1 1   19   21    6 o 33.32549 1.714516   53.13907   351.1   11.12669 1.142741          ?        ? 
1 1 1   19   21    7 o 109.5633 1.262574   101.4588   211.8   120.1683 2.766637          ?        ? 
1 1 1   19   21    8 o 69.84114 1.248680   86.33532   233.6   48.83716 1.744184          ?        ? 
1 1 1   19   21    9 o 19.07671 2.916304   26.47325    17.2   3.668802 1.112669          ?        ? 
1 1 1   19   21   10 o 50.02569 1.352552   62.30390   147.7   25.08017 1.353247          ?        ? 
1 1 1   19   21   11 o 24.00785 2.192044   34.36990   246.8   5.803924 1.052525          ?        ? 
1 1 1   19   21   12 o 35.54071 1.523038   46.61469   243.5   12.69044 1.082597          ?        ? 
1 1 1   19   21   13 o 24.72748 1.824214   36.53327   278.7   6.164790 0.9021643          ?        ? 
1 1 1   19   21   14 o 20.95333 2.081035   21.49740   197.9   4.450677 0.8720922          ?        ? 
1 1 1   19   21   15 o 36.04469 1.042877   39.09412   303.2   13.05131 0.7518036          ?        ? 
1 1 1   19   21   16 o 28.99304 1.244663   32.16357   337.8   8.480345 0.7217315          ?        ? 
1 1 1   19   21   17 o 22.74455 1.586603   19.27739   290.1   5.262625 0.7217315          ?        ? 
1 1 1   19   21   18 o 8.492902 3.168324   14.19111   280.8  0.6615872 0.7217315          ?        ? 
1 1 1   19   21   19 o 9.190342 3.556484   7.223243    38.9  0.8119479 0.9322364          ?        ? 
1 1 1   19   22    0 f 6.240873 4.257441   37.60975     0.0 -0.7518036 1.563751 -0.7518036 1.563751 
1 1 1   19   22    1 o 59.41399 1.290672   90.29137   323.3   35.33477 1.533679          ?        ? 
1 1 1   19   22    2 o 148.4393 1.458640   170.7057   239.7   220.6093 4.330389          ?        ? 
1 1 1   19   22    3 o 91.06215 1.287927   109.9032   293.7   82.99912 2.345627          ?        ? 
1 1 1   19   22    4 o 88.91896 1.369699   112.8588    85.6   79.14989 2.435844          ?        ? 
1 1 1   19   22    5 o 9.865959 4.063659   46.09060   137.7  0.3007214 1.293102          ?        ? 
1 1 1   19   22    6 o 138.4111 1.575185   157.9941   289.7   191.8904 4.360461          ?        ? 
1 1 1   19   22    7 f 59.66017 1.260143   78.45793   197.2   35.63549 1.503607          ?        ? 
1 1 1   19   22    8 o 109.4080 1.236880   142.3719   279.4   119.8676 2.706493          ?        ? 
1 1 1   19   22    9 o 36.94047 1.628141   47.10910   277.3   13.68283 1.202886          ?        ? 
1 1 1   19   22   10 o 57.01818 1.213050   52.29672   280.9   32.56813 1.383319          ?        ? 
1 1 1   19   22   11 f 33.90830 1.685047   49.90730   229.5   11.54770 1.142741          ?        ? 
1 1 1   19   22   12 o 21.87085 2.337479   25.86385   108.9   4.841615 1.022453          ?        ? 
1 1 1   19   22   13 o 13.70492 3.410599   27.43884    17.5   2.014834 0.9322364          ?        ? 
1 1 1   19   22   14 o 28.02452 1.394985   31.77707   344.1   7.908974 0.7818757          ?        ? 
1 1 1   19   22   15 o 9.115093 3.134259   15.82765   359.6  0.8119479 0.6916593          ?        ? 
1 1 1   19   22   16 o 17.53834 2.057583   8.115056   302.8   3.157575 0.7217315          ?        ? 
1 1 1   19   22   17 o 9.255985 3.199836   15.22979   237.5  0.8720922 0.7217315          ?        ? 
1 1 1   19   22   18 f 15.29194 2.458170   21.80821    87.3   2.495988 0.7518036          ?        ? 
1 1 1   19   23    0 f 151.6375 2.103056   100.4274   180.0   230.3526 6.375295   230.3526 6.375295 
1 1 1   19   23    1 o 98.16371 1.225387   93.16434   150.3   96.44137 2.405771          ?        ? 
1 1 1   19   23    2 o 125.5932 1.388757   136.5519   127.2   157.9088 3.488369          ?        ? 
1 1 1   19   23    3 o 47.17466 1.466167   88.37891   266.1   22.28346 1.383319          ?        ? 
1 1 1   19   23    4 o 99.44491 1.270080   92.64276   123.1   98.99751 2.526060          ?        ? 
1 1 1   19   23    5 o 184.8333 1.805956   215.6094   213.7   342.3714 6.676016          ?        ? 
1 1 1   19   23    6 o 29.57598 2.287745   13.91700    22.2   8.781067 1.353247          ?        ? 
1 1 1   19   23    7 o 98.49821 1.434941   113.4447    20.6   97.19318 2.826782          ?        ? 
1 1 1   19   23    8 o 54.97977 1.367418   87.72443    41.3   30.28265 1.503607          ?        ? 
1 1 1   19   23    9 o 27.62325 2.014009   38.99139   349.5   7.668397 1.112669          ?        ? 
1 1 1   19   23   10 o 91.94336 1.177461   91.10974    99.5   84.71323 2.165194          ?        ? 
1 1 1   19   23   11 o 45.49593 1.388069   43.52361     7.0   20.77985 1.263030          ?        ? 
1 1 1   19   23   12 o 70.34901 1.154171   82.79777     3.1   49.64911 1.623896          ?        ? 
1 1 1   19   23   13 o 37.19054 1.212895   46.12772    32.4   13.89333 0.9021643          ?        ? 
1 1 1   19   23   14 f 17.13360 1.930672   22.69030   266.1   2.977142 0.6615872          ?        ? 
1 1 1   19   23   15 o 40.64013 1.146941   46.76125   100.1   16.62990 0.9322364          ?        ? 
1 1 1   19   23   16 o 46.84796 1.059150   54.70197   319.7   22.10303 0.9923807          ?        ? 
1 1 1   19   23   17 o 28.29366 1.434858   31.30792   344.2   8.149551 0.8119479          ?        ? 
1 1 1   19   23   18 o 16.93821 2.396793   19.60520   324.1   3.067359 0.8119479          ?        ? 
1 1 1   19   24    0 o 43.82615 2.103158   35.71592   180.0   19.36646 1.834401   19.36646 1.834401 
1 1 1   19   24    1 o 41.47973 1.522467   66.87490   353.9   17.23134 1.263030          ?        ? 
1 1 1   19   24    2 o 66.68092 1.217661   81.23835   144.9   44.50677 1.623896          ?        ? 
1 1 1   19   24    3 o 138.6235 1.366684   155.8938   139.9   192.4016 3.789090          ?        ? 
1 1 1   19   24    4 f 115.0752 1.228233   104.5371   188.1   132.5580 2.826782          ?        ? 
1 1 1   19   24    5 o 99.44666 1.330537   107.6984   137.7   99.02757 2.646349          ?        ? 
1 1 1   19   24    6 o 63.58802 1.442411   56.70151   138.4   40.50718 1.834401          ?        ? 
1 1 1   19   24    7 o 19.84541 3.772928   42.08396   298.2   4.119884 1.443463          ?        ? 
1 1 1   19   24    8 o 90.27492 1.365781   114.3901   123.5   81.67595 2.465916          ?        ? 
1 1 1   19   24    9 o 52.10310 1.385199   56.59103   191.9   27.21529 1.443463          ?        ? 
1 1 1   19   24   10 o 43.76353 1.443017   58.88554    17.0   19.21610 1.263030          ?        ? 
1 1 1   19   24   11 o 29.04053 2.019270   39.69424   235.4   8.510417 1.172814          ?        ? 
1 1 1   19   24   12 o 37.27109 1.533013   39.05524   235.2   13.98355 1.142741          ?        ? 
1 1 1   19   24   13 o 20.15362 2.014397   28.80641   101.6   4.119884 0.8119479          ?        ? 
1 1 1   19   24   14 o 27.10872 1.497577   27.50241    90.0   7.427820 0.8119479          ?        ? 
1 1 1   19   24   15 o 28.02214 1.556077   24.30316   254.9   7.969118 0.8720922          ?        ? 
1 1 1   19   24   16 o 16.37033 2.479937   16.67719   230.1   2.796710 0.8119479          ?        ? 
1 1 1   19   24   17 f 20.47515 2.056201   17.08218   157.0   4.360461 0.8420200          ?        ? 
1 1 1   19   24   18 o 24.32910 1.792282   30.52886   234.2   6.164790 0.8720922          ?        ? 
1 1 1   19   25    0 o 58.37105 2.092391   54.29342   180.0   34.25217 2.435844   34.25217 2.435844 
1 1 1   19   25    1 o 72.83508 1.279928   106.3066   308.5   53.10741 1.864473          ?        ? 
1 1 1   19   25    2 f 10.10708 3.972158   17.65349    50.4  0.6014429 1.172814          ?        ? 
1 1 1   19   25    3 o 65.83253 1.324713   87.11979   101.7   43.39410 1.744184          ?        ? 
1 1 1   19   25    4 o 65.11834 1.316152   60.52549   219.6   42.46187 1.714112          ?        ? 
1 1 1   19   25    5 o 58.22118 1.342940   67.74325    95.9   33.95145 1.563751          ?        ? 
1 1 1   19   25    6 o 56.75442 1.351154   63.36016   133.0   32.26741 1.533679          ?        ? 
1 1 1   19   25    7 o 49.43314 1.612100   43.80247    44.4   24.50880 1.593824          ?        ? 
1 1 1   19   25    8 o 15.01558 4.094093   32.01985   153.0   2.375700 1.263030          ?        ? 
1 1 1   19   25    9 o 64.02208 1.385660   69.11517   217.2   41.10862 1.774257          ?        ? 
1 1 1   19   25   10 o 9.400887 3.804811   25.67776   291.1  0.4210100 1.112669          ?        ? 
1 1 1   19   25   11 o 65.63904 1.214082   78.10564    99.7   43.24374 1.593824          ?        ? 
1 1 1   19   25   12 o 34.04023 1.766859   36.87055    42.4   11.69806 1.202886          ?        ? 
1 1 1   19   25   13 o 24.14077 1.743979   28.35139    70.5   5.894140 0.8420200          ?        ? 
1 1 1   19   25   14 o 9.857823 3.395282   14.60995   330.7  0.9623086 0.8119479          ?        ? 
1 1 1   19   25   15 o 29.03580 1.449969   25.40188    53.2   8.540489 0.8420200          ?        ? 
1 1 1   19   25   16 o 15.07089 2.896889   16.55569   160.3   2.495988 0.8420200          ?        ? 
1 1 1   19   25   17 o 8.632826 3.278852   10.71022   162.6  0.6916593 0.7818757          ?        ? 
1 1 1   19   26    0 o 6.732976 4.496404   11.12996   360.0 -0.3909379 1.593824 -0.3909379 1.593824 
1 1 1   19   26    1 o 43.61818 1.654658   37.22375   156.1   19.06574 1.443463          ?        ? 
1 1 1   19   26    2 o 37.42358 1.848191   42.98597   347.8   14.04369 1.383319          ?        ? 
1 1 1   19   26    3 o 85.37968 1.373645   86.19061   238.6   73.01517 2.345627          ?        ? 
1 1 1   19   26    4 o 88.28632 1.294359   99.62701   137.8   78.06729 2.285483          ?        ? 
1 1 1   19   26    5 o 112.6744 1.241058   131.3847   277.2   127.1450 2.796710          ?        ? 
1 1 1   19   26    6 o 80.56622 1.194432   75.15542   266.4   65.01598 1.924617          ?        ? 
1 1 1   19   26    7 o 26.66754 2.311720   26.85697   249.4   7.157170 1.232958          ?        ? 
1 1 1   19   26    8 o 16.70882 4.152432   39.63992   263.6   2.977142 1.383319          ?        ? 
1 1 1   19   26    9 o 71.98470 1.420375   88.31779   352.3   52.02481 2.044906          ?        ? 
1 1 1   19   26   10 o 13.94566 4.251293   7.262050   214.6   2.044906 1.293102          ?        ? 
1 1 1   19   26   11 o 30.75550 1.955562   26.31798    16.6   9.562942 1.202886          ?        ? 
1 1 1   19   26   12 o 24.75222 1.761644   26.61250   264.4   6.194862 0.8720922          ?        ? 
1 1 1   19   26   13 o 12.32348 3.419938   17.59576    73.6   1.653968 0.8720922          ?        ? 
1 1 1   19   26   14 o 27.19800 1.658512   25.77574   276.6   7.518036 0.9021643          ?        ? 
1 1 1   19   26   15 o 13.12379 3.407616   20.74405    16.4   1.924617 0.9021643          ?        ? 
1 1 1   19   26   16 o 36.60768 1.355427   40.17464   203.6   13.62268 0.9923807          ?        ? 
1 1 1   19   26   17 o 8.791848 3.432085   9.456055   298.1  0.6916593 0.8720922          ?        ? 
1 1 1   19   27    0 o 80.18797 1.708070   84.82943    -0.0   64.47468 2.736565   64.47468 2.736565 
1 1 1   19   27    1 o 56.05320 1.502180   62.04528    82.7   31.48553 1.684040          ?        ? 
1 1 1   19   27    2 o 15.75639 3.767192   21.40361   297.1   2.616277 1.172814          ?        ? 
1 1 1   19   27    3 o 58.79593 1.483253   69.11774    54.9   34.64311 1.744184          ?        ? 
1 1 1   19   27    4 o 44.42590 1.590728   46.03426    48.9   19.78747 1.413391          ?        ? 
1 1 1   19   27    5 o 40.86208 1.619074   53.92279   358.0   16.75019 1.323174          ?        ? 
1 1 1   19   27    6 o 44.14071 1.635070   58.51704   157.0   19.54689 1.443463          ?        ? 
1 1 1   19   27    7 o 51.76971 1.423163   62.49082   207.4   26.88450 1.473535          ?        ? 
1 1 1   19   27    8 o 54.25561 1.330243   59.57912   221.5   29.53085 1.443463          ?        ? 
1 1 1   19   27    9 o 36.74385 2.005145   42.43186    59.3   13.62268 1.473535          ?        ? 
1 1 1   19   27   10 o 11.92750 4.355421   13.72754   349.6   1.263030 1.353247          ?        ? 
1 1 1   19   27   11 o 52.17094 1.296935   61.27602   229.8   27.36565 1.353247          ?        ? 
1 1 1   19   27   12 o 20.19112 2.159593   22.85693   222.7   4.149956 0.8720922          ?        ? 
1 1 1   19   27   13 o 13.23478 3.392612   9.267382   277.4   1.924617 0.9021643          ?        ? 
1 1 1   19   27   14 o 41.82174 1.222394   30.87640   108.8   17.65235 1.022453          ?        ? 
1 1 1   19   27   15 f 12.59861 3.548878   20.88988   221.0   1.804329 0.9322364          ?        ? 
1 1 1   19   27   16 o 21.99037 2.188023   24.15051    95.6   5.082192 0.9623086          ?        ? 
1 1 1   19   28    0 o 21.87602 5.062285   30.52769     0.0   5.533275 1.924617   5.533275 1.924617 
1 1 1   19   28    1 f 39.32495 1.835302   32.40831   137.6   15.51723 1.443463          ?        ? 
1 1 1   19   28    2 o 63.56188 1.324725   74.77849   273.2   40.47711 1.684040          ?        ? 
1 1 1   19   28    3 o 41.93777 1.756812   49.61820   116.7   17.65235 1.473535          ?        ? 
1 1 1   19   28    4 o 7.148985 3.368212   14.13835   196.1  -1.413391 1.263030          ?        ? 
1 1 1   19   28    5 o 81.75974 1.342511   87.93649    77.6   67.00074 2.195267          ?        ? 
1 1 1   19   28    6 o 41.04927 1.758208   51.57165   155.8   16.93062 1.443463          ?        ? 
1 1 1   19   28    7 o 72.92651 1.319559   66.68919   134.2   53.34798 1.924617          ?        ? 
1 1 1   19   28    8 o 18.32574 3.409295   22.57631   148.3   3.548513 1.202886          ?        ? 
1 1 1   19   28    9 o 27.94758 2.205840   35.85472   281.5   7.908974 1.232958          ?        ? 
1 1 1   19   28   10 o 42.15779 1.676310   47.78021   106.9   17.92300 1.413391          ?        ? 
1 1 1   19   28   11 o 21.16698 2.344172   21.67743   129.6   4.570966 0.9923807          ?        ? 
1 1 1   19   28   12 o 37.61150 1.399206   39.57571   292.5   14.28427 1.052525          ?        ? 
1 1 1   19   28   13 o 22.09380 2.177780   21.85590   314.4   5.022048 0.9623086          ?        ? 
1 1 1   19   28   14 o 23.80797 2.084135   18.34264   256.7   5.833996 0.9923807          ?        ? 
1 1 1   19   28   15 o 13.22724 3.558998   13.22937   129.4   2.014834 0.9623086          ?        ? 
1 1 1   19   28   16 o 17.32992 2.602910   19.01100    42.2   3.247792 0.9021643          ?        ? 
1 1 1   19   29    0 o 76.02173 1.821959   66.31767   180.0   58.00917 2.766637   58.00917 2.766637 
1 1 1   19   29    1 o 94.22604 1.356383   87.33102   201.0   88.98347 2.556132          ?        ? 
1 1 1   19   29    2 f 33.25505 2.260720   50.77361    87.2   11.12669 1.503607          ?        ? 
1 1 1   19   29    3 o 11.77557 4.125166   16.73892    52.2   1.263030 1.202886          ?        ? 
1 1 1   19   29    4 o 56.26892 1.416256   45.51430   229.9   31.75618 1.593824          ?        ? 
1 1 1   19   29    5 o 25.90020 2.380209   31.29070   163.9   6.766232 1.232958          ?        ? 
1 1 1   19   29    6 o 52.84288 1.394261   40.92653    53.6   28.02724 1.473535          ?        ? 
1 1 1   19   29    7 o 15.70432 3.853484   19.75843   267.2   2.646349 1.202886          ?        ? 
1 1 1   19   29    8 o 19.99720 3.007636   17.69060   296.0   4.089812 1.202886          ?        ? 
1 1 1   19   29    9 o 48.78757 1.540974   61.74910   335.9   23.96750 1.503607          ?        ? 
1 1 1   19   29   10 o 55.66927 1.323473   60.25272   348.6   31.18481 1.473535          ?        ? 
1 1 1   19   29   11 o 19.68331 2.368088   11.50783    54.8   3.969523 0.9322364          ?        ? 
1 1 1   19   29   12 o 10.27009 3.782359   5.074098   357.7  0.9623086 1.022453          ?        ? 
1 1 1   19   29   13 o 22.57823 2.064459   42.15535   271.6   5.232553 0.9322364          ?        ? 
1 1 1   19   29   14 o 25.43547 1.832552   30.98457   309.7   6.645944 0.9322364          ?        ? 
1 1 1   19   29   15 o 19.30625 2.647985   12.58908   256.7   3.999595 1.022453          ?        ? 
1 1 1   19   29   16 o 14.03847 3.697232   21.54734   312.2   2.405771 1.052525          ?        ? 
1 1 1   19   30    0 o 59.64489 2.072642   73.97623   180.0   35.81593 2.465916   35.81593 2.465916 
1 1 1   19   30    1 o 63.12505 1.405351   76.16660   273.4   39.96588 1.774257          ?        ? 
1 1 1   19   30    2 o 112.6380 1.361600   114.5581   131.0   127.2352 3.067359          ?        ? 
1 1 1   19   30    3 o 24.71185 2.494670   21.10518   127.8   6.164790 1.232958          ?        ? 
1 1 1   19   30    4 o 24.19576 2.672168   24.30183    10.4   5.924213 1.293102          ?        ? 
1 1 1   19   30    5 o 44.20829 1.496523   45.02698    12.5   19.63711 1.323174          ?        ? 
1 1 1   19   30    6 o 32.38403 2.042943   32.80396    95.6   10.58539 1.323174          ?        ? 
1 1 1   19   30    7 o 10.75099 4.143953   6.089559   176.6  0.8420200 1.263030          ?        ? 
1 1 1   19   30    8 o 27.80835 2.270955   13.69647   232.0   7.848830 1.263030          ?        ? 
1 1 1   19   30    9 o 64.26016 1.286931   66.27570   210.1   41.52963 1.653968          ?        ? 
1 1 1   19   30   10 o 37.01219 1.746860   34.31359   171.7   13.86326 1.293102          ?        ? 
1 1 1   19   30   11 f 8.879409 3.561201   16.37567    39.2  0.4811543 0.9623086          ?        ? 
1 1 1   19   30   12 o 41.18979 1.387166   54.91977    98.9   17.17119 1.142741          ?        ? 
1 1 1   19   30   13 o 27.54273 1.637754   24.38139   221.6   7.728541 0.9021643          ?        ? 
1 1 1   19   30   14 o 22.41645 2.146434   23.90230    61.8   5.232553 0.9623086          ?        ? 
1 1 1   19   30   15 o 18.64205 2.742330   18.89926   331.4   3.789090 1.022453          ?        ? 
1 1 1   19   31    0 o 83.67941 1.888850   69.62643   180.0   70.33875 3.157575   70.33875 3.157575 
1 1 1   19   31    1 o 73.85839 1.384342   78.92182   253.4   54.73130 2.044906          ?        ? 
1 1 1   19   31    2 f 21.37850 3.235304   26.28701    57.2   4.661182 1.383319          ?        ? 
1 1 1   19   31    3 o 28.60142 2.260556   46.70518   334.1   8.269840 1.293102          ?        ? 
1 1 1   19   31    4 o 34.71559 1.905735   18.17033    42.9   12.14915 1.323174          ?        ? 
1 1 1   19   31    5 o 45.68396 1.579836   46.50052   272.4   20.99036 1.443463          ?        ? 
1 1 1   19   31    6 o 29.61438 2.081688   34.05508   351.1   8.871283 1.232958          ?        ? 
1 1 1   19   31    7 o 20.40733 2.947191   24.39190    40.6   4.270245 1.202886          ?        ? 
1 1 1   19   31    8 o 44.51014 1.520155   46.63825   117.3   19.96791 1.353247          ?        ? 
1 1 1   19   31    9 o 36.67369 1.844983   37.30775    96.8   13.62268 1.353247          ?        ? 
1 1 1   19   31   10 o 20.19076 3.053273   24.57800   244.9   4.270245 1.232958          ?        ? 
1 1 1   19   31   11 f 36.53201 1.399393   36.74050    12.9   13.50239 1.022453          ?        ? 
1 1 1   19   31   12 o 13.79958 3.569665   5.348413   274.5   2.135122 0.9923807          ?        ? 
1 1 1   19   31   13 o 20.78126 2.460036   25.09289   149.9   4.540894 1.022453          ?        ? 
1 1 1   19   31   14 f 33.22412 1.493464   29.33974   208.7   11.30713 0.9923807          ?        ? 
1 1 1   19   31   15 o 21.99325 2.187737   22.76536   143.4   5.142337 0.9623086          ?        ? 
1 1 1   19   32    0 o 14.40073 6.665555   44.95700   180.0   3.157575 2.105050   3.157575 2.105050 
1 1 1   19   32    1 o 27.12151 2.494784   40.06820   290.9   7.457891 1.353247          ?        ? 
1 1 1   19   32    2 o 44.44160 1.691666   43.56277   285.4   19.87769 1.503607          ?        ? 
1 1 1   19   32    3 o 12.16386 4.134799   12.31282   218.9   1.443463 1.202886          ?        ? 
1 1 1   19   32    4 o 24.54337 2.695584   39.90244   148.5   6.134717 1.323174          ?        ? 
1 1 1   19   32    5 o 9.830617 4.027043   10.29840    26.5  0.4210100 1.263030          ?        ? 
1 1 1   19   32    6 o 23.52436 2.684515   25.61905   345.6   5.653563 1.263030          ?        ? 
1 1 1   19   32    7 o 46.11648 1.532414   50.11535   358.5   21.44144 1.413391          ?        ? 
1 1 1   19   32    8 o 65.21934 1.406332   67.93045   312.9   42.85281 1.834401          ?        ? 
1 1 1   19   32    9 o 47.29470 1.653199   48.90406   161.2   22.67440 1.563751          ?        ? 
1 1 1   19   32   10 o 12.67877 3.691112   14.36305   246.6   1.774257 0.9923807          ?        ? 
1 1 1   19   32   11 o 24.88622 2.175093   25.02385   183.8   6.375295 1.082597          ?        ? 
1 1 1   19   32   12 o 43.02851 1.397778   40.20268   106.3   18.79509 1.202886          ?        ? 
1 1 1   19   32   13 o 44.37241 1.355443   45.55614   124.2   20.02805 1.202886          ?        ? 
1 1 1   19   32   14 o 14.15197 3.161658   10.71937    35.1   2.315555 0.8720922          ?        ? 
1 1 1   19   33    0 o 28.03167 3.571278   61.53642   180.0   8.089407 2.014834   8.089407 2.014834 
1 1 1   19   33    1 o 30.91780 2.480253   48.32433    30.9   9.713303 1.533679          ?        ? 
1 1 1   19   33    2 o 16.03755 4.378561   12.76408    90.7   2.796710 1.443463          ?        ? 
1 1 1   19   33    3 o 32.36285 2.183662   24.62805   295.6   10.61547 1.413391          ?        ? 
1 1 1   19   33    4 o 11.64297 4.256946   21.13628   224.1   1.202886 1.293102          ?        ? 
1 1 1   19   33    5 o 32.21577 2.100286   26.96715   154.4   10.52525 1.353247          ?        ? 
1 1 1   19   33    6 o 15.19026 3.930384   15.28296   230.1   2.526060 1.202886          ?        ? 
1 1 1   19   33    7 o 69.93600 1.354485   63.54094   256.5   49.25817 1.894545          ?        ? 
1 1 1   19   33    8 o 10.79864 4.186629   4.953128   284.1  0.9322364 1.293102          ?        ? 
1 1 1   19   33    9 o 44.25757 1.732675   46.96654   350.4   19.90776 1.533679          ?        ? 
1 1 1   19   33   10 o 42.66011 1.445095   50.65666   266.1   18.43423 1.232958          ?        ? 
1 1 1   19   33   11 o 25.37525 1.955411   30.57886   354.5   6.615872 0.9923807          ?        ? 
1 1 1   19   33   12 f 15.80487 3.338042   12.09017   166.8   2.826782 1.022453          ?        ? 
1 1 1   19   33   13 o 7.628200 3.377844   12.86992   356.4      -0.06 1.022453          ?        ? 
1 1 1   19   34    0 o 52.73955 2.261263   56.17770   180.0   28.17760 2.375700   28.17760 2.375700 
1 1 1   19   34    1 o 40.23644 1.868465   48.03929   254.4   16.35925 1.503607          ?        ? 
1 1 1   19   34    2 o 37.70098 1.914357   35.29934   312.1   14.37449 1.443463          ?        ? 
1 1 1   19   34    3 o 24.11163 2.993292   26.93065   279.0   5.984357 1.443463          ?        ? 
1 1 1   19   34    4 o 25.43022 2.542452   34.51038   121.8   6.615872 1.293102          ?        ? 
1 1 1   19   34    5 o 13.01918 4.385613   16.38096   134.3   1.744184 1.353247          ?        ? 
1 1 1   19   34    6 o 24.65257 2.622653   32.46120   184.1   6.255006 1.293102          ?        ? 
1 1 1   19   34    7 o 28.76870 2.351943   22.27551    44.0   8.510417 1.353247          ?        ? 
1 1 1   19   34    8 o 23.37508 2.701659   29.34334   359.2   5.683635 1.263030          ?        ? 
1 1 1   19   34    9 o 43.78045 1.785902   48.60746    23.8   19.54689 1.563751          ?        ? 
1 1 1   19   34   10 o 10.05669 3.808758   16.08168   333.8  0.9021643 1.052525          ?        ? 
1 1 1   19   34   11 o 31.33782 1.823263   42.25125    31.4   10.10424 1.142741          ?        ? 
1 1 1   19   34   12 o 9.628367 3.768028   12.79173   256.2  0.8420200 1.052525          ?        ? 
1 1 1   19   34   13 o 7.623054 3.396510   1.547997   315.9      -0.09 1.052525          ?        ? 
1 1 1   19   35    0 o 21.07505 5.784522   21.66785     0.0   5.533275 2.105050   5.533275 2.105050 
1 1 1   19   35    1 o 25.00651 2.826045   34.38095   193.9   6.435439 1.413391          ?        ? 
1 1 1   19   35    2 o 24.48755 2.763131   34.25214   293.0   6.164790 1.353247          ?        ? 
1 1 1   19   35    3 o 24.83343 2.785194   25.41294   332.2   6.345222 1.383319          ?        ? 
1 1 1   19   35    4 o 48.00447 1.566112   43.21098   202.2   23.27584 1.503607          ?        ? 
1 1 1   19   35    5 o 59.66555 1.512036   52.80625   264.7   35.99636 1.804329          ?        ? 
1 1 1   19   35    6 o 55.16801 1.444518   54.35590   203.1   30.76381 1.593824          ?        ? 
1 1 1   19   35    7 o 18.95610 3.459848   16.36126   215.5   3.939451 1.263030          ?        ? 
1 1 1   19   35    8 o 13.05639 4.434078   11.74671   284.3   1.864473 1.383319          ?        ? 
1 1 1   19   35    9 o 10.50215 4.157081   14.50341    62.3  0.8720922 1.293102          ?        ? 
1 1 1   19   35   10 o 48.66011 1.421409   45.80672    85.9   24.08779 1.383319          ?        ? 
1 1 1   19   35   11 o 13.98395 3.780423   13.49981    44.1   2.315555 1.082597          ?        ? 
1 1 1   19   35   12 o 20.17396 2.757687   22.83150    46.4   4.450677 1.112669          ?        ? 
1 1 1   19   36    0 o 29.05873 3.941556   44.79510     0.0   9.172004 2.225339   9.172004 2.225339 
1 1 1   19   36    1 o 37.75346 1.951523   34.64877    85.5   14.49477 1.473535          ?        ? 
1 1 1   19   36    2 o 20.38127 3.246055   11.26984   239.6   4.360461 1.323174          ?        ? 
1 1 1   19   36    3 o 53.80665 1.592844   52.34211    65.1   29.32034 1.714112          ?        ? 
1 1 1   19   36    4 o 9.260786 4.099082   10.86850    67.9 -0.2405772 1.503607          ?        ? 
1 1 1   19   36    5 o 7.472018 3.521739   10.96185     9.9  -1.353247 1.383319          ?        ? 
1 1 1   19   36    6 o 22.55591 3.199744   26.81382     9.9   5.412986 1.443463          ?        ? 
1 1 1   19   36    7 o 16.50299 4.183630   18.96203   205.6   3.127503 1.383319          ?        ? 
1 1 1   19   36    8 o 34.04152 2.164321   33.55316   317.0   11.96871 1.473535          ?        ? 
1 1 1   19   36    9 o 19.63470 3.658973   28.31514   292.2   4.390533 1.383319          ?        ? 
1 1 1   19   36   10 f 11.31374 3.812093   1.374606   249.2   1.443463 1.022453          ?        ? 
1 1 1   19   36   11 o 12.37840 3.972480   15.43375   158.5   1.864473 1.112669          ?        ? 
1 1 1   19   37    0 o 37.31620 3.187540   54.16105     0.0   14.58499 2.345627   14.58499 2.345627 
1 1 1   19   37    1 o 10.47775 4.214406   5.377922    35.4  0.7217315 1.353247          ?        ? 
1 1 1   19   37    2 o 45.61205 1.747152   41.52390   117.1   21.14072 1.593824          ?        ? 
1 1 1   19   37    3 o 27.56327 2.563903   28.22954   157.5   7.878902 1.413391          ?        ? 
1 1 1   19   37    4 f 23.30018 2.903941   30.51277   302.5   5.713707 1.353247          ?        ? 
1 1 1   19   37    5 o 12.52274 4.420091   16.14039   344.3   1.653968 1.383319          ?        ? 
1 1 1   19   37    6 o 16.84357 4.058961   15.35766   231.1   3.247792 1.353247          ?        ? 
1 1 1   19   37    7 o 16.28263 3.995371   14.17665   228.7   3.067359 1.293102          ?        ? 
1 1 1   19   37    8 o 20.21498 3.784713   16.24747    50.8   4.691255 1.473535          ?        ? 
1 1 1   19   37    9 o 12.41972 4.459363   11.94111   266.7   1.774257 1.413391          ?        ? 
1 1 1   19   37   10 o 8.398014 3.600330   16.23631    28.2  0.2706493 1.082597          ?        ? 
1 1 1   19   38    0 o 14.19581 6.660419   5.382077   180.0   3.307936 2.105050   3.307936 2.105050 
1 1 1   19   38    1 o 26.72931 2.643897   21.28256   110.1   7.457891 1.413391          ?        ? 
1 1 1   19   38    2 o 19.18151 3.819733   7.530134   164.8   4.119884 1.413391          ?        ? 
1 1 1   19   38    3 o 21.76704 3.108475   26.26978   173.5   5.022048 1.353247          ?        ? 
1 1 1   19   38    4 o 9.978927 4.163441   9.622333   342.9  0.4811543 1.383319          ?        ? 
1 1 1   19   38    5 o 8.714154 3.907805   18.79097    23.6 -0.3307936 1.413391          ?        ? 
1 1 1   19   38    6 o 14.80435 4.431036   8.681542    78.1   2.616277 1.413391          ?        ? 
1 1 1   19   38    7 o 20.58572 3.359899   19.14479    14.8   4.661182 1.383319          ?        ? 
1 1 1   19   38    8 o 21.56938 3.206671   18.03567   210.5   5.142337 1.383319          ?        ? 
1 1 1   19   38    9 o 27.52570 2.075772   25.33789   116.6   7.969118 1.142741          ?        ? 
1 1 1   19   39    0 o 9.588229 5.871011   2.486505   360.0   1.202886 2.105050   1.202886 2.105050 
1 1 1   19   39    1 o 25.64867 2.755290   34.71829    80.6   6.916593 1.413391          ?        ? 
1 1 1   19   39    2 o 51.66783 1.716984   46.10553   260.8   27.24536 1.774257          ?        ? 
1 1 1   19   39    3 o 19.41677 3.774297   22.61109    84.2   4.270245 1.413391          ?        ? 
1 1 1   19   39    4 o 27.03548 2.836420   30.43711   126.6   7.788685 1.533679          ?        ? 
1 1 1   19   39    5 o 17.34521 4.409916   17.74124    40.1   3.638730 1.533679          ?        ? 
1 1 1   19   39    6 o 13.84248 4.480730   16.53058   307.1   2.315555 1.413391          ?        ? 
1 1 1   19   39    7 o 15.90415 4.394725   13.82212   263.7   3.187647 1.443463          ?        ? 
1 1 1   19   39    8 o 14.69414 4.494112   17.35750   209.9   2.796710 1.443463          ?        ? 
1 1 1   19   40    0 o 38.09492 3.078383   35.72936     0.0   15.36687 2.315555   15.36687 2.315555 
1 1 1   19   40    1 o 21.62420 3.407143   26.28467   167.6   5.142337 1.473535          ?        ? 
1 1 1   19   40    2 o 26.84331 2.800712   25.33553   125.3   7.698469 1.503607          ?        ? 
1 1 1   19   40    3 o 28.92715 2.598955   24.39720   232.7   8.871283 1.503607          ?        ? 
1 1 1   19   40    4 o 29.98534 2.607527   28.96920   227.3   9.562942 1.563751          ?        ? 
1 1 1   19   40    5 o 37.78945 2.228188   35.48739   203.2   15.03607 1.684040          ?        ? 
1 1 1   19   40    6 o 11.07916 4.390028   12.65671   185.7   1.263030 1.443463          ?        ? 
1 1 1   19   40    7 o 18.96030 4.009363   19.10546    86.9   4.420605 1.473535          ?        ? 
1 1 1   19   41    0 o 11.95618 6.338072   1.955189   180.0   2.586205 2.014834   2.586205 2.014834 
1 1 1   19   41    1 o 23.96707 3.199556   19.81764   265.2   6.345222 1.533679          ?        ? 
1 1 1   19   41    2 o 30.83437 2.535728   24.14370   226.1   10.16438 1.563751          ?        ? 
1 1 1   19   41    3 o 27.98389 2.686558   29.02027   236.3   8.480345 1.503607          ?        ? 
1 1 1   19   41    4 o 27.99251 2.685731   21.55194    24.4   8.510417 1.503607          ?        ? 
1 1 1   19   41    5 o 17.29067 4.208032   13.58508    70.3   3.759018 1.443463          ?        ? 
1 1 1   19   42    0 o 39.66742 3.107831   28.95225   180.0   16.93062 2.435844   16.93062 2.435844 
1 1 1   19   42    1 o 29.22560 2.778208   22.39263    69.7   9.352437 1.623896          ?        ? 
1 1 1   19   42    2 o 9.740932 4.166053   11.77908   152.0  0.5713707 1.443463          ?        ? 
1 1 1   19   42    3 o 20.28018 4.072908   18.38110   318.5   5.082192 1.593824          ?        ? 
1 1 1   20    0    0 o 17.91535 3.936545   13.89575   180.0   3.638730 1.232958   3.638730 1.232958 
1 1 1   20    0    1 o 14.20557 3.288949   53.24875     0.0   2.315555 0.8119479   2.315555 0.8119479 
1 1 1   20    0    2 o 116.1226 1.450734   113.7227   180.0   134.9337 3.368080   134.9337 3.368080 
1 1 1   20    0    3 o 168.3624 1.786608   207.7560   180.0   283.6405 6.014429   283.6405 6.014429 
1 1 1   20    0    4 o 31.92496 1.418975   107.8865   180.0   10.25460 0.9021643   10.25460 0.9021643 
1 1 1   20    0    5 o 35.83297 1.389271   77.44983   180.0   12.90095 0.9923807   12.90095 0.9923807 
1 1 1   20    0    6 o 100.4392 1.272936   189.8112   180.0   100.9522 2.556132   100.9522 2.556132 
1 1 1   20    0    7 o 179.7396 1.824096   165.2231   180.0   323.3357 6.555727   323.3357 6.555727 
1 1 1   20    0    8 o 54.91537 0.9864067   4.446404   180.0   30.19243 1.082597   30.19243 1.082597 
1 1 1   20    0    9 o 75.36623 1.237688   109.3902     0.0   56.86643 1.864473   56.86643 1.864473 
1 1 1   20    0   10 o 44.09933 1.058327   37.10169     0.0   19.48675 0.9322364   19.48675 0.9322364 
1 1 1   20    0   11 o 61.64151 3.288375   83.91908     0.0   38.43220 4.029667   38.43220 4.029667 
1 1 1   20    0   12 o 65.33373 2.935546   79.24669     0.0   43.06331 3.819162   43.06331 3.819162 
1 1 1   20    0   13 o 105.6992 3.536566   115.2675   180.0   112.6803 7.457891   112.6803 7.457891 
1 1 1   20    0   14 x        ?      ?   57.84809   180.0          ?        ?          ?        ? 
1 1 1   20    0   15 x        ?      ?   91.23702   180.0          ?        ?          ?        ? 
1 1 1   20    0   16 o 34.06876 1.194846   54.05010   180.0   11.66799 0.8119479   11.66799 0.8119479 
1 1 1   20    0   17 o 25.49236 1.726586   33.93325     0.0   6.615872 0.8720922   6.615872 0.8720922 
1 1 1   20    0   18 o 3.905857 2.773509   5.548311   180.0 -0.9021643 0.8420200 -0.9021643 0.8420200 
1 1 1   20    0   19 o 34.58844 1.527915   47.60059   180.0   12.11907 1.052525   12.11907 1.052525 
1 1 1   20    0   20 o 21.28068 2.458164   23.67905     0.0   4.811543 1.022453   4.811543 1.022453 
1 1 1   20    0   21 o 13.42097 4.523632   18.08815     0.0   2.495988 1.082597   2.495988 1.082597 
1 1 1   20    1    0 o 246.2276 2.388175   313.4549     0.0   606.7656 11.75821   606.7656 11.75821 
1 1 1   20    1    1 o 177.7178 1.328321   266.7083   110.8   315.9380 4.721327          ?        ? 
1 1 1   20    1    2 o 119.5809 1.018492   88.27168   332.3   143.0231 2.435844          ?        ? 
1 1 1   20    1    3 o 96.93240 0.9617389   114.6045   358.7   93.97545 1.864473          ?        ? 
1 1 1   20    1    4 o 113.3046 0.9952868   144.0688    17.4   128.4081 2.255411          ?        ? 
1 1 1   20    1    5 o 257.8943 1.708284   337.8330   353.5   665.5868 8.811138          ?        ? 
1 1 1   20    1    6 o 60.34163 0.7724655   67.38477   131.1   36.41737 0.9322364          ?        ? 
1 1 1   20    1    7 o 121.5686 0.9771023   171.0816   185.6   147.8347 2.375700          ?        ? 
1 1 1   20    1    8 o 62.25384 0.6762797   72.74424   219.7   38.76299 0.8420200          ?        ? 
1 1 1   20    1    9 o 12.73146 2.007729   22.69814    69.9   1.623896 0.5112265          ?        ? 
1 1 1   20    1   10 o 59.95187 1.128611   84.42712    81.4   35.96629 1.353247          ?        ? 
1 1 1   20    1   11 o 20.05303 1.949520   11.87771   129.8   4.029667 0.7818757          ?        ? 
1 1 1   20    1   12 o 95.93636 1.097108   135.9750   106.7   92.11098 2.105050          ?        ? 
1 1 1   20    1   13 o 66.84347 0.9897560   99.56590   114.5   44.71728 1.323174          ?        ? 
1 1 1   20    1   14 o 47.04686 1.086632   54.40448    86.7   22.16317 1.022453          ?        ? 
1 1 1   20    1   15 o 57.30658 1.075756   72.16961   111.5   32.89893 1.232958          ?        ? 
1 1 1   20    1   16 o 12.37246 3.052946   21.87749   182.2   1.623896 0.7518036          ?        ? 
1 1 1   20    1   17 o 30.49275 0.9368960   39.16889    27.8   9.322365 0.5713707          ?        ? 
1 1 1   20    1   18 o 25.40496 1.242897   30.28915    35.9   6.495584 0.6315150          ?        ? 
1 1 1   20    1   19 o 8.366291 3.046283   3.903422   107.3  0.6315150 0.6615872          ?        ? 
1 1 1   20    1   20 o 36.20760 1.079712   48.98743   296.3   13.23174 0.7818757          ?        ? 
1 1 1   20    1   21 o 14.52798 2.688580   17.83275   276.6   2.345627 0.7518036          ?        ? 
1 1 1   20    2    0 o 19.68693 2.266129   63.10222   180.0   4.029667 0.8720922   4.029667 0.8720922 
1 1 1   20    2    1 o 45.94304 0.8836462   48.01841     3.3   21.11065 0.8119479          ?        ? 
1 1 1   20    2    2 o 140.3312 1.103615   176.1736   252.5   196.9725 3.097431          ?        ? 
1 1 1   20    2    3 o 122.6330 1.054449   169.1330     9.4   150.4209 2.586205          ?        ? 
1 1 1   20    2    4 o 8.438592 2.849712   46.85086   264.5  0.6615872 0.5713707          ?        ? 
1 1 1   20    2    5 o 71.91277 0.8572594   73.98072   131.4   51.72409 1.232958          ?        ? 
1 1 1   20    2    6 o 62.15744 0.7982799   81.33110   347.6   38.64271 0.9923807          ?        ? 
1 1 1   20    2    7 o 37.02700 0.8121681   44.80610   312.5   13.71290 0.6014429          ?        ? 
1 1 1   20    2    8 o 85.41421 0.9682042   98.60166     7.0   72.98509 1.653968          ?        ? 
1 1 1   20    2    9 f 106.6876 1.071110   107.9063   279.7   113.8832 2.285483          ?        ? 
1 1 1   20    2   10 o 71.24882 1.012973   90.19732   288.4   50.79185 1.443463          ?        ? 
1 1 1   20    2   11 f 36.72480 1.432989   70.74632   299.3   13.50239 1.052525          ?        ? 
1 1 1   20    2   12 o 31.85129 1.699456   41.61801   296.1   10.16438 1.082597          ?        ? 
1 1 1   20    2   13 o 27.17109 1.549478   34.48026   128.4   7.397748 0.8420200          ?        ? 
1 1 1   20    2   14 o 47.16819 1.179470   55.72148    34.6   22.28346 1.112669          ?        ? 
1 1 1   20    2   15 o 57.98223 1.089153   65.08838   269.3   33.68080 1.263030          ?        ? 
1 1 1   20    2   16 o 41.33517 1.200407   54.10297   267.5   17.14112 0.9923807          ?        ? 
1 1 1   20    2   17 o 33.64382 1.519526   37.21045   275.0   11.39734 1.022453          ?        ? 
1 1 1   20    2   18 o 41.99811 1.181459   54.85286   221.5   17.74257 0.9923807          ?        ? 
1 1 1   20    2   19 o 9.905895 2.961257   14.80060   126.0   1.052525 0.6315150          ?        ? 
1 1 1   20    2   20 o 18.74121 1.845290   25.96087   168.9   3.608657 0.6916593          ?        ? 
1 1 1   20    2   21 o 12.01100 3.008160   13.65858    38.3   1.653968 0.7217315          ?        ? 
1 1 1   20    3    0 o 242.7239 2.304904   302.8170   180.0   589.5945 11.18684   589.5945 11.18684 
1 1 1   20    3    1 o 130.7837 1.080709   141.0065   248.9   171.0804 2.826782          ?        ? 
1 1 1   20    3    2 o 79.70795 0.8677419   139.9146   207.6   63.54244 1.383319          ?        ? 
1 1 1   20    3    3 o 69.81413 0.8399544   81.71717   202.3   48.74695 1.172814          ?        ? 
1 1 1   20    3    4 o 107.4483 0.9655706   161.6942   322.4   115.4770 2.074978          ?        ? 
1 1 1   20    3    5 o 39.38807 0.8780061   57.14323   344.3   15.51723 0.6916593          ?        ? 
1 1 1   20    3    6 o 36.70014 0.9013416   62.24865   169.2   13.47232 0.6615872          ?        ? 
1 1 1   20    3    7 o 97.11190 0.9754444   126.7939   251.7   94.33632 1.894545          ?        ? 
1 1 1   20    3    8 o 37.98307 1.108415   35.59869   177.1   14.43463 0.8420200          ?        ? 
1 1 1   20    3    9 o 56.31487 0.9078001   60.91036   135.9   31.72611 1.022453          ?        ? 
1 1 1   20    3   10 o 73.22124 1.088362   95.70081   330.6   53.64870 1.593824          ?        ? 
1 1 1   20    3   11 o 74.58263 1.108816   94.24963    27.2   55.66354 1.653968          ?        ? 
1 1 1   20    3   12 f 10.19648 3.821690   9.508449   298.0  0.7818757 1.052525          ?        ? 
1 1 1   20    3   13 o 21.23203 2.903534   32.78165   306.9   4.540894 1.232958          ?        ? 
1 1 1   20    3   14 o 47.85915 1.225276   44.07753   226.6   22.94505 1.172814          ?        ? 
1 1 1   20    3   15 o 25.11898 1.915501   44.24995   217.0   6.345222 0.9623086          ?        ? 
1 1 1   20    3   16 o 47.31437 1.239384   67.92886   222.2   22.46389 1.172814          ?        ? 
1 1 1   20    3   17 o 15.33450 3.049898   24.84200   180.0   2.495988 0.9021643          ?        ? 
1 1 1   20    3   18 o 19.09488 2.283576   30.30243   283.7   3.728946 0.8720922          ?        ? 
1 1 1   20    3   19 f 14.90646 3.402351   10.45692    59.7   2.465916 0.9923807          ?        ? 
1 1 1   20    3   20 o 30.65325 1.177251   32.88097    55.9   9.502798 0.7217315          ?        ? 
1 1 1   20    3   21 o 18.05607 2.081859   17.55042   163.7   3.428224 0.7518036          ?        ? 
1 1 1   20    4    0 o 47.53724 1.203654   106.0718     0.0   22.64433 1.142741   22.64433 1.142741 
1 1 1   20    4    1 o 84.23792 0.8746271   88.74372   192.7   70.97026 1.473535          ?        ? 
1 1 1   20    4    2 o 146.9524 1.197137   180.2444   139.4   216.0082 3.518441          ?        ? 
1 1 1   20    4    3 o 104.1819 0.9814113   120.3148   251.2   108.5604 2.044906          ?        ? 
1 1 1   20    4    4 o 142.3653 1.161778   125.8144   316.5   202.7464 3.307936          ?        ? 
1 1 1   20    4    5 o 111.9510 1.128199   157.4426   273.7   125.3708 2.526060          ?        ? 
1 1 1   20    4    6 o 75.61929 0.8947760   104.0503    24.8   57.19722 1.353247          ?        ? 
1 1 1   20    4    7 o 61.57207 0.8791300   84.85797   276.0   37.92097 1.082597          ?        ? 
1 1 1   20    4    8 o 19.37313 1.940326   40.63775   143.3   3.759018 0.7518036          ?        ? 
1 1 1   20    4    9 o 18.49697 2.032235   19.80550   204.9   3.428224 0.7518036          ?        ? 
1 1 1   20    4   10 o 76.33310 1.122784   113.4611   355.0   58.30989 1.714112          ?        ? 
1 1 1   20    4   11 o 37.53078 1.522406   36.92956   224.7   14.10384 1.142741          ?        ? 
1 1 1   20    4   12 o 33.37101 1.667120   30.17622   185.4   11.15676 1.112669          ?        ? 
1 1 1   20    4   13 o 48.34872 1.554961   45.74428   190.3   23.42620 1.503607          ?        ? 
1 1 1   20    4   14 o 30.11372 1.997239   38.55036    16.8   9.111859 1.202886          ?        ? 
1 1 1   20    4   15 o 32.66194 1.519170   33.07610    59.2   10.70568 0.9923807          ?        ? 
1 1 1   20    4   16 o 34.67342 1.561134   56.20820    75.9   12.08900 1.082597          ?        ? 
1 1 1   20    4   17 o 37.79418 1.432227   54.59700   247.5   14.37449 1.082597          ?        ? 
1 1 1   20    4   18 o 16.47778 3.124540   18.35565   147.4   2.916998 0.9923807          ?        ? 
1 1 1   20    4   19 o 12.34259 3.850390   18.99920   320.6   1.684040 1.052525          ?        ? 
1 1 1   20    4   20 o 37.50219 0.9221585   42.34687   189.2   14.16398 0.6916593          ?        ? 
1 1 1   20    4   21 o 19.60560 1.840626   18.21284   344.1   3.999595 0.7217315          ?        ? 
1 1 1   20    5    0 o 57.12951 1.238301   29.72678    -0.0   32.68842 1.413391   32.68842 1.413391 
1 1 1   20    5    1 o 167.7472 1.263858   171.1246     8.0   281.4753 4.240172          ?        ? 
1 1 1   20    5    2 o 88.24702 0.8689695   138.2575   279.2   77.88686 1.533679          ?        ? 
1 1 1   20    5    3 o 46.10475 0.9783854   46.02486   185.7   21.26101 0.9021643          ?        ? 
1 1 1   20    5    4 o 27.68435 1.466438   51.65898   128.0   7.668397 0.8119479          ?        ? 
1 1 1   20    5    5 o 147.6667 1.252441   181.5523   324.8   218.1433 3.698874          ?        ? 
1 1 1   20    5    6 o 101.9144 1.003247   129.9857   258.8   103.8993 2.044906          ?        ? 
1 1 1   20    5    7 o 32.25177 0.9324185   28.61592    77.7   10.40496 0.6014429          ?        ? 
1 1 1   20    5    8 o 43.92770 1.129561   61.03807   346.1   19.30632 0.9923807          ?        ? 
1 1 1   20    5    9 o 57.00045 1.055155   74.03589   272.9   32.50799 1.202886          ?        ? 
1 1 1   20    5   10 o 73.87062 1.139858   124.8662    44.1   54.61102 1.684040          ?        ? 
1 1 1   20    5   11 o 125.8091 1.374422   181.6852    87.1   158.4501 3.458297          ?        ? 
1 1 1   20    5   12 o 23.84987 2.584831   29.58071    80.9   5.713707 1.232958          ?        ? 
1 1 1   20    5   13 o 5.971119 2.907428   9.411439   147.0  -1.984761 1.112669          ?        ? 
1 1 1   20    5   14 o 34.71164 1.646049   43.19252   244.5   12.08900 1.142741          ?        ? 
1 1 1   20    5   15 o 64.82786 1.275662   74.63708    51.1   42.13108 1.653968          ?        ? 
1 1 1   20    5   16 o 44.26707 1.256769   49.39153   225.9   19.66718 1.112669          ?        ? 
1 1 1   20    5   17 o 34.56292 1.479119   32.75220   269.1   12.02886 1.022453          ?        ? 
1 1 1   20    5   18 o 12.33367 3.573280   18.47961   177.1   1.653968 0.9322364          ?        ? 
1 1 1   20    5   19 o 11.61446 3.867743   14.45075    51.3   1.443463 1.052525          ?        ? 
1 1 1   20    5   20 o 13.08858 3.869670   17.37768   289.5   1.984761 1.082597          ?        ? 
1 1 1   20    5   21 o 15.85650 2.086170   17.47066   317.9   2.646349 0.6615872          ?        ? 
1 1 1   20    6    0 o 235.3456 2.313296   287.4631   360.0   554.3199 10.88612   554.3199 10.88612 
1 1 1   20    6    1 o 182.6804 1.465084   226.2279    19.9   333.8609 5.352841          ?        ? 
1 1 1   20    6    2 o 57.87420 0.9353021   83.75450    98.0   33.50037 1.082597          ?        ? 
1 1 1   20    6    3 o 87.56002 0.9444767   126.3181   171.7   76.68397 1.653968          ?        ? 
1 1 1   20    6    4 f 100.6703 1.045517   128.1523   176.0   101.3732 2.105050          ?        ? 
1 1 1   20    6    5 o 157.2152 1.310269   202.2122   336.5   247.2832 4.119884          ?        ? 
1 1 1   20    6    6 o 120.8812 1.107046   167.0217    49.6   146.1807 2.676421          ?        ? 
1 1 1   20    6    7 o 39.57100 1.215927   58.33810   343.4   15.66759 0.9623086          ?        ? 
1 1 1   20    6    8 o 33.96921 1.372179   54.48756   189.9   11.54770 0.9322364          ?        ? 
1 1 1   20    6    9 o 37.74020 1.274912   47.12175    65.4   14.25420 0.9623086          ?        ? 
1 1 1   20    6   10 o 7.081550 3.106108   2.418830   153.9 -0.2105050 0.8420200          ?        ? 
1 1 1   20    6   11 o 22.63834 2.391070   23.01292    29.5   5.142337 1.082597          ?        ? 
1 1 1   20    6   12 f 77.24688 1.128968   125.4502   228.3   59.72328 1.744184          ?        ? 
1 1 1   20    6   13 o 37.02070 1.705843   34.11710    86.5   13.74297 1.263030          ?        ? 
1 1 1   20    6   14 o 21.83446 2.754559   42.64569   355.0   4.811543 1.202886          ?        ? 
1 1 1   20    6   15 o 41.34461 2.000222   60.34346    45.4   17.20127 1.653968          ?        ? 
1 1 1   20    6   16 o 9.033332 3.950114   29.75523   109.4 -0.2105050 1.353247          ?        ? 
1 1 1   20    6   17 o 19.92145 2.641688   30.28092   193.3   4.059740 1.052525          ?        ? 
1 1 1   20    6   18 f 18.87399 2.788295   15.82176    23.7   3.698874 1.052525          ?        ? 
1 1 1   20    6   19 f 15.04778 3.795148   20.06173    26.0   2.556132 1.142741          ?        ? 
1 1 1   20    6   20 o 31.50472 1.956783   32.26884   119.8   10.25460 1.232958          ?        ? 
1 1 1   20    6   21 o 18.90542 3.383132   29.60679   319.8   4.149956 1.232958          ?        ? 
1 1 1   20    7    0 f 129.8219 1.703223   233.2010    -0.0   168.6747 4.420605   168.6747 4.420605 
1 1 1   20    7    1 o 87.16299 1.069533   133.6214    80.9   75.99231 1.864473          ?        ? 
1 1 1   20    7    2 o 190.3007 1.643453   226.6273   151.3   362.3694 6.255006          ?        ? 
1 1 1   20    7    3 o 125.7813 1.231277   156.6649   214.8   158.2697 3.097431          ?        ? 
1 1 1   20    7    4 o 93.04862 1.114997   105.2120   231.0   86.60778 2.074978          ?        ? 
1 1 1   20    7    5 o 143.3651 1.258555   189.1971    64.1   205.6333 3.608657          ?        ? 
1 1 1   20    7    6 o 95.33012 1.009449   136.1128    30.6   90.90809 1.924617          ?        ? 
1 1 1   20    7    7 o 53.68864 1.092236   67.19675    51.0   28.83919 1.172814          ?        ? 
1 1 1   20    7    8 o 53.40733 1.126143   34.33508   231.7   28.53847 1.202886          ?        ? 
1 1 1   20    7    9 o 10.60781 3.580839   20.92520   301.4   1.052525 0.9021643          ?        ? 
1 1 1   20    7   10 o 53.11738 1.188905   73.56161   295.4   28.23775 1.263030          ?        ? 
1 1 1   20    7   11 o 82.37704 1.314198   86.87398   216.2   67.93298 2.165194          ?        ? 
1 1 1   20    7   12 o 64.49728 1.305512   67.71554    91.5   41.64992 1.684040          ?        ? 
1 1 1   20    7   13 o 65.20551 1.521928   63.38296   140.1   42.61223 1.984761          ?        ? 
1 1 1   20    7   14 o 21.81523 3.032685   7.374778    17.0   4.811543 1.323174          ?        ? 
1 1 1   20    7   15 o 57.84493 1.325682   68.63454   260.3   33.56051 1.533679          ?        ? 
1 1 1   20    7   16 o 27.37574 2.471617   42.19950   120.8   7.608253 1.353247          ?        ? 
1 1 1   20    7   17 o 18.30827 3.038707   35.79105   107.6   3.458297 1.112669          ?        ? 
1 1 1   20    7   18 o 35.22387 1.750174   36.05844   225.6   12.60023 1.232958          ?        ? 
1 1 1   20    7   19 o 9.075617 3.756907   10.63439   157.1  0.3909379 1.112669          ?        ? 
1 1 1   20    7   20 o 10.47617 4.082644   20.58173   186.4  0.9923807 1.232958          ?        ? 
1 1 1   20    7   21 o 20.91797 2.515840   27.73865   144.2   4.721327 1.052525          ?        ? 
1 1 1   20    8    0 o 10.50926 4.908573   52.42157    -0.0   1.623896 1.142741   1.623896 1.142741 
1 1 1   20    8    1 o 51.40670 1.052973   87.94843    89.8   26.43342 1.082597          ?        ? 
1 1 1   20    8    2 o 31.63744 1.378260   37.98929   115.2   10.01402 0.8720922          ?        ? 
1 1 1   20    8    3 o 70.36572 1.111160   85.43405    77.4   49.52882 1.563751          ?        ? 
1 1 1   20    8    4 o 56.55673 1.090019   80.04328   305.2   31.99676 1.232958          ?        ? 
1 1 1   20    8    5 o 42.46859 1.132965   76.52014    60.7   18.04329 0.9623086          ?        ? 
1 1 1   20    8    6 f 15.40452 1.854556   18.30492   166.2   2.375700 0.5713707          ?        ? 
1 1 1   20    8    7 o 118.6853 1.393574   127.5563    27.4   140.9782 3.307936          ?        ? 
1 1 1   20    8    8 o 96.78273 1.242872   114.4305    70.4   93.73488 2.405771          ?        ? 
1 1 1   20    8    9 o 56.54559 1.196598   47.91640    79.9   31.99676 1.353247          ?        ? 
1 1 1   20    8   10 o 90.90454 1.157836   122.8311   271.0   82.69839 2.105050          ?        ? 
1 1 1   20    8   11 o 86.49125 1.216915   107.9778    76.8   74.87964 2.105050          ?        ? 
1 1 1   20    8   12 o 47.57632 1.516997   54.63200   294.7   22.67440 1.443463          ?        ? 
1 1 1   20    8   13 o 16.78554 4.140807   50.53785   119.7   2.977142 1.383319          ?        ? 
1 1 1   20    8   14 f 44.06558 1.706102   63.96869   152.7   19.48675 1.503607          ?        ? 
1 1 1   20    8   15 o 11.23957 4.231369   19.04879   344.6  0.9923807 1.293102          ?        ? 
1 1 1   20    8   16 o 33.88429 2.041239   34.08550   231.0   11.60785 1.383319          ?        ? 
1 1 1   20    8   17 o 10.58549 4.259635   23.45209     2.1  0.6615872 1.383319          ?        ? 
1 1 1   20    8   18 o 30.28414 1.787400   28.50249   278.4   9.322365 1.082597          ?        ? 
1 1 1   20    8   19 o 12.01913 3.976716   22.13459   261.5   1.563751 1.112669          ?        ? 
1 1 1   20    8   20 o 23.53124 2.683730   26.53652   319.4   5.894140 1.263030          ?        ? 
1 1 1   20    8   21 o 14.78920 3.906396   21.93389   248.9   2.706493 1.172814          ?        ? 
1 1 1   20    9    0 f 165.3224 2.201865   143.4980    -0.0   273.6265 7.277459   273.6265 7.277459 
1 1 1   20    9    1 o 70.17440 1.049909   93.85291    54.2   49.25817 1.473535          ?        ? 
1 1 1   20    9    2 f 109.4510 1.181444   187.3612    38.1   119.8375 2.586205          ?        ? 
1 1 1   20    9    3 o 45.44626 1.058733   37.38350   188.1   20.65956 0.9623086          ?        ? 
1 1 1   20    9    4 o 151.1253 1.382968   179.6003   173.1   228.5182 4.180028          ?        ? 
1 1 1   20    9    5 o 46.45892 1.035655   75.95359   328.0   21.59180 0.9623086          ?        ? 
1 1 1   20    9    6 o 107.9152 0.9892594   150.4624   106.1   116.4995 2.135122          ?        ? 
1 1 1   20    9    7 o 72.38544 0.9555227   70.03903   333.0   52.41575 1.383319          ?        ? 
1 1 1   20    9    8 o 103.6895 1.261592   114.6596    58.2   107.5981 2.616277          ?        ? 
1 1 1   20    9    9 o 75.95708 1.167934   79.25084   203.5   57.73852 1.774257          ?        ? 
1 1 1   20    9   10 o 14.37975 3.482587   9.952609   338.0   2.165194 0.9923807          ?        ? 
1 1 1   20    9   11 o 48.43682 1.272749   76.01458    35.8   23.48635 1.232958          ?        ? 
1 1 1   20    9   12 o 31.00521 2.279279   21.47598   110.7   9.653158 1.413391          ?        ? 
1 1 1   20    9   13 o 87.36659 1.376826   113.0193   285.4   76.47346 2.405771          ?        ? 
1 1 1   20    9   14 f 22.27847 2.969625   31.27171   312.6   5.022048 1.323174          ?        ? 
1 1 1   20    9   15 o 23.71560 2.726269   23.70593   143.9   5.713707 1.293102          ?        ? 
1 1 1   20    9   16 o 49.59410 1.637187   59.23945    79.9   24.77945 1.623896          ?        ? 
1 1 1   20    9   17 o 11.52393 4.432526   18.49526   252.6   1.052525 1.443463          ?        ? 
1 1 1   20    9   18 o 20.74173 2.827184   17.88406   318.0   4.480750 1.172814          ?        ? 
1 1 1   20    9   19 o 12.15808 3.920100   11.04194    12.3   1.623896 1.082597          ?        ? 
1 1 1   20    9   20 f 27.81894 2.216041   38.63098   265.3   8.089407 1.232958          ?        ? 
1 1 1   20    9   21 o 13.20647 4.231802   10.78464   163.6   2.225339 1.263030          ?        ? 
1 1 1   20   10    0 o 150.4070 1.940127   168.1690   180.0   226.4433 5.833996   226.4433 5.833996 
1 1 1   20   10    1 o 62.61309 1.008599   82.05815   137.9   39.21407 1.263030          ?        ? 
1 1 1   20   10    2 f 81.97097 1.045560   138.7863   289.0   67.21124 1.714112          ?        ? 
1 1 1   20   10    3 o 179.3404 1.492369   222.2432     0.8   321.8321 5.352841          ?        ? 
1 1 1   20   10    4 o 113.1178 1.209608   140.7673     1.8   128.0171 2.736565          ?        ? 
1 1 1   20   10    5 o 168.9447 1.361699   201.9566   223.6   285.5952 4.601038          ?        ? 
1 1 1   20   10    6 o 201.2190 1.509444   260.8625   190.3   405.2823 6.074574          ?        ? 
1 1 1   20   10    7 o 73.44030 0.8189549   105.1753   196.0   53.94942 1.202886          ?        ? 
1 1 1   20   10    8 o 72.91113 1.216725   82.12581   182.1   53.19762 1.774257          ?        ? 
1 1 1   20   10    9 o 20.48030 2.496186   27.56741   345.8   4.210100 1.022453          ?        ? 
1 1 1   20   10   10 o 8.480026 3.531481   21.64484   282.3  0.1503607 0.9923807          ?        ? 
1 1 1   20   10   11 o 104.6357 1.322033   97.18635    36.9   109.6130 2.766637          ?        ? 
1 1 1   20   10   12 o 54.89438 1.506500   76.48058   204.5   30.19243 1.653968          ?        ? 
1 1 1   20   10   13 o 58.25980 1.367859   71.20820   212.3   34.01160 1.593824          ?        ? 
1 1 1   20   10   14 o 38.12256 1.932629   43.08520   329.4   14.61506 1.473535          ?        ? 
1 1 1   20   10   15 o 62.40450 1.445672   58.44002    75.7   39.12386 1.804329          ?        ? 
1 1 1   20   10   16 o 33.91264 2.039533   30.07865    86.5   11.63792 1.383319          ?        ? 
1 1 1   20   10   17 o 6.999782 3.383812   1.669648   315.7  -2.165194 1.443463          ?        ? 
1 1 1   20   10   18 o 32.62231 2.074112   34.51421    34.1   10.88612 1.353247          ?        ? 
1 1 1   20   10   19 o 9.433543 3.841763   16.73268   261.6  0.5412986 1.142741          ?        ? 
1 1 1   20   10   20 o 7.132360 3.350888   4.020862   236.1 -0.9923807 1.232958          ?        ? 
1 1 1   20   11    0 o 4.642253 3.309417   20.92130     0.0  -1.473535 1.232958  -1.473535 1.232958 
1 1 1   20   11    1 o 114.2336 1.197793   113.6167   264.7   130.5432 2.736565          ?        ? 
1 1 1   20   11    2 o 242.5638 1.965023   296.1546   255.9   589.0231 9.532870          ?        ? 
1 1 1   20   11    3 o 61.15357 1.008083   67.48720    95.7   37.40975 1.232958          ?        ? 
1 1 1   20   11    4 o 245.9523 2.011312   306.2766    86.3   605.7131 9.893736          ?        ? 
1 1 1   20   11    5 o 24.14530 1.370013   37.83832   195.5   5.833996 0.6615872          ?        ? 
1 1 1   20   11    6 o 143.7406 1.244807   169.3894   260.2   206.7460 3.578585          ?        ? 
1 1 1   20   11    7 o 136.2394 1.158834   160.1122   182.0   185.7256 3.157575          ?        ? 
1 1 1   20   11    8 o 85.38435 1.197471   105.5658   102.9   72.95502 2.044906          ?        ? 
1 1 1   20   11    9 o 85.83272 1.226252   96.79051    85.9   73.73690 2.105050          ?        ? 
1 1 1   20   11   10 f 63.23563 1.260226   57.92032   240.1   40.02603 1.593824          ?        ? 
1 1 1   20   11   11 o 44.78630 1.477209   34.52016   342.7   20.08819 1.323174          ?        ? 
1 1 1   20   11   12 o 48.28016 1.619456   52.36567    65.2   23.36606 1.563751          ?        ? 
1 1 1   20   11   13 o 25.66180 2.753881   38.53761    13.8   6.645944 1.413391          ?        ? 
1 1 1   20   11   14 o 31.09139 2.272962   37.21735    22.2   9.743376 1.413391          ?        ? 
1 1 1   20   11   15 o 24.18091 2.425082   20.35475   242.6   5.924213 1.172814          ?        ? 
1 1 1   20   11   16 o 34.02128 2.121412   41.51205   266.6   11.72814 1.443463          ?        ? 
1 1 1   20   11   17 f 19.96577 3.238298   14.88878   305.8   4.149956 1.293102          ?        ? 
1 1 1   20   11   18 o 11.05286 4.283361   25.64803    57.8   1.022453 1.353247          ?        ? 
1 1 1   20   11   19 o 10.10314 4.127422   18.07590    73.4  0.6615872 1.323174          ?        ? 
1 1 1   20   11   20 o 8.069164 3.652503   10.44484    95.3 -0.3007214 1.263030          ?        ? 
1 1 1   20   12    0 o 76.60957 1.610991   84.81287   360.0   58.79104 2.465916   58.79104 2.465916 
1 1 1   20   12    1 o 122.8720 1.284904   181.5836   193.9   151.0524 3.157575          ?        ? 
1 1 1   20   12    2 o 42.00464 1.217072   50.55387   173.1   17.65235 1.022453          ?        ? 
1 1 1   20   12    3 o 136.0639 1.359241   186.6657     1.9   185.2444 3.698874          ?        ? 
1 1 1   20   12    4 o 129.2416 1.163408   142.3520   239.9   167.1109 3.007215          ?        ? 
1 1 1   20   12    5 o 74.63461 0.9267273   101.8054   145.0   55.72369 1.383319          ?        ? 
1 1 1   20   12    6 o 61.61934 0.8784557   67.92126    34.0   37.98112 1.082597          ?        ? 
1 1 1   20   12    7 o 74.91563 0.8831097   103.8315    68.3   56.14469 1.323174          ?        ? 
1 1 1   20   12    8 o 53.89900 1.339044   39.17097   279.6   29.07976 1.443463          ?        ? 
1 1 1   20   12    9 o 159.5439 1.573877   212.1108   172.2   254.8915 5.022048          ?        ? 
1 1 1   20   12   10 o 107.2212 1.276131   137.6442   169.9   115.0861 2.736565          ?        ? 
1 1 1   20   12   11 o 26.99014 2.061252   69.78860   292.0   7.307531 1.112669          ?        ? 
1 1 1   20   12   12 o 77.27794 1.284171   81.31445    82.4   59.81350 1.984761          ?        ? 
1 1 1   20   12   13 o 17.83158 4.053866   23.16262     6.9   3.368080 1.413391          ?        ? 
1 1 1   20   12   14 o 48.51539 1.642596   67.73717   137.5   23.63671 1.593824          ?        ? 
1 1 1   20   12   15 o 73.26933 1.374950   70.98218   203.6   53.91936 2.014834          ?        ? 
1 1 1   20   12   16 o 23.25404 3.039022   26.85886     3.8   5.563347 1.413391          ?        ? 
1 1 1   20   12   17 o 15.42039 4.115010   25.47284   256.5   2.646349 1.293102          ?        ? 
1 1 1   20   12   18 o 11.11083 4.054924   11.61024   262.1   1.202886 1.172814          ?        ? 
1 1 1   20   12   19 o 9.805644 4.054043   11.77287   275.9  0.5713707 1.293102          ?        ? 
1 1 1   20   12   20 o 19.43275 3.928789   19.69492    28.3   4.540894 1.473535          ?        ? 
1 1 1   20   13    0 o 97.59649 1.541497   69.16703   180.0   95.35877 3.007215   95.35877 3.007215 
1 1 1   20   13    1 o 50.78569 1.095456   43.65797   273.4   25.80190 1.112669          ?        ? 
1 1 1   20   13    2 o 157.8100 1.448250   223.7077   221.2   249.2079 4.570966          ?        ? 
1 1 1   20   13    3 o 108.4906 1.233481   141.9233   309.1   117.7625 2.676421          ?        ? 
1 1 1   20   13    4 o 136.2619 1.213815   178.9682    80.4   185.7857 3.307936          ?        ? 
1 1 1   20   13    5 o 28.85332 1.198578   39.66619    74.6   8.329985 0.6916593          ?        ? 
1 1 1   20   13    6 o 69.04741 0.9363873   93.20800   349.4   47.69442 1.293102          ?        ? 
1 1 1   20   13    7 o 121.4653 1.114102   133.5531   302.9   147.6242 2.706493          ?        ? 
1 1 1   20   13    8 f 68.93800 0.8288182   105.3795   252.6   47.54406 1.142741          ?        ? 
1 1 1   20   13    9 o 28.09365 1.926765   62.91630     5.2   7.908974 1.082597          ?        ? 
1 1 1   20   13   10 o 90.95741 1.256348   100.8135   262.0   82.81869 2.285483          ?        ? 
1 1 1   20   13   11 o 49.43369 1.459999   61.10867   217.5   24.47873 1.443463          ?        ? 
1 1 1   20   13   12 o 58.70700 1.306215   66.80558   289.9   34.52282 1.533679          ?        ? 
1 1 1   20   13   13 f 10.33297 4.220562   12.08500    23.9  0.4210100 1.383319          ?        ? 
1 1 1   20   13   14 o 34.54282 2.089382   35.98903   211.4   12.02886 1.443463          ?        ? 
1 1 1   20   13   15 o 39.16187 1.766155   37.37319   337.8   15.45708 1.383319          ?        ? 
1 1 1   20   13   16 o 19.80514 3.627477   18.67272   252.2   4.210100 1.383319          ?        ? 
1 1 1   20   13   17 o 27.66137 2.283021   32.83881   184.8   7.848830 1.263030          ?        ? 
1 1 1   20   13   18 o 30.39432 2.374561   37.68429   139.7   9.562942 1.443463          ?        ? 
1 1 1   20   13   19 f 31.38018 2.443707   30.05453   197.3   10.34482 1.533679          ?        ? 
1 1 1   20   13   20 o 15.51286 4.369772   14.83644   335.7   3.067359 1.413391          ?        ? 
1 1 1   20   14    0 o 25.29291 2.668489   43.05346   180.0   6.615872 1.323174   6.615872 1.323174 
1 1 1   20   14    1 o 138.9483 1.352668   157.3008    90.9   193.1835 3.759018          ?        ? 
1 1 1   20   14    2 o 42.07307 1.322306   97.69395   203.6   17.71249 1.112669          ?        ? 
1 1 1   20   14    3 o 87.53364 1.013471   118.7877   315.3   76.65389 1.774257          ?        ? 
1 1 1   20   14    4 o 100.9137 1.072795   126.4468    27.7   101.8844 2.165194          ?        ? 
1 1 1   20   14    5 o 69.67662 0.9495111   97.66758   176.5   48.56651 1.323174          ?        ? 
1 1 1   20   14    6 o 64.36058 0.9111274   83.33438    43.3   41.43941 1.172814          ?        ? 
1 1 1   20   14    7 o 147.9299 1.250212   195.7263   202.3   219.0154 3.698874          ?        ? 
1 1 1   20   14    8 o 26.68609 1.183229   27.28963   258.8   7.127099 0.6315150          ?        ? 
1 1 1   20   14    9 o 43.97387 1.572887   46.14566    36.2   19.36646 1.383319          ?        ? 
1 1 1   20   14   10 o 29.78968 2.119912   38.40915   348.8   8.901355 1.263030          ?        ? 
1 1 1   20   14   11 o 75.01883 1.242670   99.83656    31.3   56.35520 1.864473          ?        ? 
1 1 1   20   14   12 o 69.60342 1.296149   88.46015   275.5   48.53644 1.804329          ?        ? 
1 1 1   20   14   13 o 12.41795 4.416347   5.340485   124.5   1.383319 1.383319          ?        ? 
1 1 1   20   14   14 o 69.47308 1.515011   79.41000   289.7   48.50637 2.105050          ?        ? 
1 1 1   20   14   15 o 21.58920 3.412668   23.30380   192.9   4.811543 1.473535          ?        ? 
1 1 1   20   14   16 o 24.04214 2.876863   23.10750    47.1   5.954284 1.383319          ?        ? 
1 1 1   20   14   17 o 29.36948 2.201439   39.49392    25.4   8.841210 1.293102          ?        ? 
1 1 1   20   14   18 o 10.94562 4.373310   9.613454    69.1  0.9021643 1.443463          ?        ? 
1 1 1   20   14   19 f 13.43412 4.482006   11.65130   104.0   2.135122 1.413391          ?        ? 
1 1 1   20   14   20 o 9.400805 4.073390   11.97043   167.5  0.3909379 1.413391          ?        ? 
1 1 1   20   15    0 o 9.886768 5.121633   41.34806   180.0   1.443463 1.293102   1.443463 1.293102 
1 1 1   20   15    1 o 223.4688 1.870520   262.9550   164.7   500.0998 8.360056          ?        ? 
1 1 1   20   15    2 o 75.35389 0.9976972   116.4390   193.1   56.80628 1.503607          ?        ? 
1 1 1   20   15    3 o 94.19794 1.053506   124.0870   196.1   88.77297 1.984761          ?        ? 
1 1 1   20   15    4 o 80.61709 0.9698636   79.61224   224.1   65.01598 1.563751          ?        ? 
1 1 1   20   15    5 o 60.20830 0.9739635   80.29333   220.3   36.26701 1.172814          ?        ? 
1 1 1   20   15    6 o 62.36674 0.9643648   69.11503   204.1   38.91335 1.202886          ?        ? 
1 1 1   20   15    7 o 22.72575 1.587916   29.13060   260.8   5.172409 0.7217315          ?        ? 
1 1 1   20   15    8 o 16.79500 1.969596   34.89479   235.3   2.826782 0.6615872          ?        ? 
1 1 1   20   15    9 o 107.8424 1.017813   125.7610   154.7   116.3792 2.195267          ?        ? 
1 1 1   20   15   10 o 26.13345 2.301430   39.15486   303.4   6.856449 1.202886          ?        ? 
1 1 1   20   15   11 o 32.76115 1.789946   34.33620   266.7   10.76583 1.172814          ?        ? 
1 1 1   20   15   12 o 23.43762 2.437835   31.27058   239.9   5.533275 1.142741          ?        ? 
1 1 1   20   15   13 o 25.56575 2.823041   24.89198   117.1   6.615872 1.443463          ?        ? 
1 1 1   20   15   14 o 36.15298 2.121097   37.82499    91.0   13.20167 1.533679          ?        ? 
1 1 1   20   15   15 o 39.66256 1.971320   52.33489    84.3   15.90816 1.563751          ?        ? 
1 1 1   20   15   16 o 9.425250 4.032490   23.66568   222.0       0.09 1.353247          ?        ? 
1 1 1   20   15   17 o 30.19944 2.340094   28.91909   180.4   9.382509 1.413391          ?        ? 
1 1 1   20   15   18 f 16.15029 4.364892   14.21717    12.9   3.037287 1.443463          ?        ? 
1 1 1   20   15   19 o 17.75673 4.347552   13.72825   227.1   3.819162 1.533679          ?        ? 
1 1 1   20   15   20 o 9.557762 4.128596   11.07662   354.0  0.4811543 1.443463          ?        ? 
1 1 1   20   16    0 f 13.87300 4.987540   14.30598   180.0   2.556132 1.263030   2.556132 1.263030 
1 1 1   20   16    1 o 96.64996 1.166793   111.3642   106.3   93.46423 2.255411          ?        ? 
1 1 1   20   16    2 o 88.03226 0.9735705   99.59317   169.2   77.52599 1.714112          ?        ? 
1 1 1   20   16    3 o 98.89629 1.109883   135.7626   196.3   97.85476 2.195267          ?        ? 
1 1 1   20   16    4 o 158.6596 1.336248   222.1502   272.4   251.9444 4.240172          ?        ? 
1 1 1   20   16    5 o 109.2628 1.059626   145.8604   278.4   119.4466 2.315555          ?        ? 
1 1 1   20   16    6 o 126.5563 1.140570   176.3133   284.2   160.2845 2.886926          ?        ? 
1 1 1   20   16    7 o 63.55918 0.9226155   78.12129   289.4   40.41696 1.172814          ?        ? 
1 1 1   20   16    8 o 29.25971 1.336096   71.45555   288.5   8.570561 0.7818757          ?        ? 
1 1 1   20   16    9 o 78.15035 0.8850367   93.86729   323.3   61.10660 1.383319          ?        ? 
1 1 1   20   16   10 o 71.21838 0.9922937   79.53405   277.5   50.76178 1.413391          ?        ? 
1 1 1   20   16   11 f 26.73590 2.362048   52.61186   307.8   7.187243 1.263030          ?        ? 
1 1 1   20   16   12 f 11.33500 4.015717   23.20980   111.5   1.142741 1.142741          ?        ? 
1 1 1   20   16   13 o 9.180605 3.773431   11.45616    22.7  0.3007214 1.112669          ?        ? 
1 1 1   20   16   14 o 32.60960 2.305467   42.49131   141.2   10.76583 1.503607          ?        ? 
1 1 1   20   16   15 o 17.15993 4.156343   19.55003    97.4   3.217719 1.413391          ?        ? 
1 1 1   20   16   16 o 37.62367 1.798398   37.64008   168.7   14.34441 1.353247          ?        ? 
1 1 1   20   16   17 o 8.549117 3.867091   9.961933    46.6 -0.5112265 1.413391          ?        ? 
1 1 1   20   16   18 o 22.35081 3.296380   20.16037     3.6   5.382914 1.473535          ?        ? 
1 1 1   20   16   19 o 5.833381 2.914433   7.043082   210.7  -3.398152 1.413391          ?        ? 
1 1 1   20   17    0 o 68.42408 1.539972   106.9739     0.0   46.91254 2.105050   46.91254 2.105050 
1 1 1   20   17    1 o 171.4378 1.438373   202.8230    27.9   294.1657 4.931832          ?        ? 
1 1 1   20   17    2 o 88.62376 1.017971   116.8908    35.5   78.57851 1.804329          ?        ? 
1 1 1   20   17    3 o 34.10088 1.278695   24.17973    68.6   11.63792 0.8720922          ?        ? 
1 1 1   20   17    4 o 70.47947 1.237371   66.55579   261.0   49.70926 1.744184          ?        ? 
1 1 1   20   17    5 o 75.40040 1.196498   92.30187   252.0   56.89650 1.804329          ?        ? 
1 1 1   20   17    6 o 63.16973 1.166330   86.51122   190.7   39.93581 1.473535          ?        ? 
1 1 1   20   17    7 o 44.66389 1.312933   58.12254   129.7   19.96791 1.172814          ?        ? 
1 1 1   20   17    8 o 50.68075 1.246065   75.76819    13.8   25.71168 1.263030          ?        ? 
1 1 1   20   17    9 o 5.706866 2.759497  0.7175549    54.9  -1.563751 0.9623086          ?        ? 
1 1 1   20   17   10 o 42.31615 0.9949157   50.61374    48.1   17.92300 0.8420200          ?        ? 
1 1 1   20   17   11 o 45.69279 0.9542997   39.97398   164.7   20.90014 0.8720922          ?        ? 
1 1 1   20   17   12 o 68.55998 1.315876   88.28209    55.5   47.12305 1.804329          ?        ? 
1 1 1   20   17   13 o 46.43674 1.392327   57.85920   250.4   21.65195 1.293102          ?        ? 
1 1 1   20   17   14 o 26.97990 2.786532   31.06414   300.9   7.427820 1.503607          ?        ? 
1 1 1   20   17   15 o 23.51150 3.133648   40.98095   337.4   5.713707 1.473535          ?        ? 
1 1 1   20   17   16 f 18.75820 3.969432   29.28242   346.5   3.909379 1.443463          ?        ? 
1 1 1   20   17   17 o 27.75832 2.816725   23.84388   319.0   8.089407 1.563751          ?        ? 
1 1 1   20   17   18 o 11.83369 4.531624   16.24906   223.0   1.383319 1.503607          ?        ? 
1 1 1   20   17   19 o 19.83199 3.930620   24.41356    48.2   4.721327 1.503607          ?        ? 
1 1 1   20   18    0 o 131.5004 1.795927   149.0475     0.0   173.1554 4.721327   173.1554 4.721327 
1 1 1   20   18    1 o 108.8226 1.257351   150.8864   253.0   118.5143 2.736565          ?        ? 
1 1 1   20   18    2 o 99.10028 1.198634   126.5979   360.0   98.27576 2.375700          ?        ? 
1 1 1   20   18    3 o 98.64424 1.204176   125.6408   223.2   97.37360 2.375700          ?        ? 
1 1 1   20   18    4 o 91.98656 1.209600   107.2412   123.8   84.68316 2.225339          ?        ? 
1 1 1   20   18    5 o 47.08694 1.277303   49.39190   119.3   22.19324 1.202886          ?        ? 
1 1 1   20   18    6 o 102.6563 1.171760   128.5587   289.4   105.4630 2.405771          ?        ? 
1 1 1   20   18    7 o 89.60280 1.141095   114.9564   336.5   80.35278 2.044906          ?        ? 
1 1 1   20   18    8 f 129.8325 1.331830   164.8182    46.4   168.7649 3.458297          ?        ? 
1 1 1   20   18    9 o 52.99377 1.220051   46.47974   142.5   28.11745 1.293102          ?        ? 
1 1 1   20   18   10 o 40.40950 1.376742   44.62354    96.0   16.35925 1.112669          ?        ? 
1 1 1   20   18   11 o 45.64707 1.152894   55.98146    22.4   20.87007 1.052525          ?        ? 
1 1 1   20   18   12 o 56.58945 1.381663   65.21712   118.4   32.11705 1.563751          ?        ? 
1 1 1   20   18   13 o 42.66448 1.656402   46.47644    38.4   18.31394 1.413391          ?        ? 
1 1 1   20   18   14 o 25.07261 2.878565   29.96360   302.2   6.435439 1.443463          ?        ? 
1 1 1   20   18   15 o 23.08122 2.996632   35.79707   327.2   5.503202 1.383319          ?        ? 
1 1 1   20   18   16 o 14.95429 4.534129   23.83511    73.9   2.526060 1.473535          ?        ? 
1 1 1   20   18   17 o 17.26345 4.068397   20.83564   126.7   3.398152 1.383319          ?        ? 
1 1 1   20   18   18 o 20.54698 3.873914   24.11959   218.9   4.871688 1.533679          ?        ? 
1 1 1   20   18   19 o 24.38838 2.527757   25.21063   187.6   6.405366 1.232958          ?        ? 
1 1 1   20   19    0 o 140.0016 1.998539   171.8632   180.0   196.3110 5.593419   196.3110 5.593419 
1 1 1   20   19    1 o 61.74620 1.388031   58.65483   316.8   38.16155 1.714112          ?        ? 
1 1 1   20   19    2 o 31.09211 1.789311   47.03324    60.8   9.683230 1.112669          ?        ? 
1 1 1   20   19    3 o 48.50073 1.302073   49.83794   334.0   23.54649 1.263030          ?        ? 
1 1 1   20   19    4 o 102.3222 1.293145   152.2508   264.7   104.8014 2.646349          ?        ? 
1 1 1   20   19    5 o 57.12337 1.237139   81.37556   121.7   32.65835 1.413391          ?        ? 
1 1 1   20   19    6 o 70.36764 1.196601   78.53548   296.5   49.55890 1.684040          ?        ? 
1 1 1   20   19    7 o 94.28537 1.212003   98.21950   282.8   88.98347 2.285483          ?        ? 
1 1 1   20   19    8 o 30.78925 1.806912   59.06238   132.7   9.502798 1.112669          ?        ? 
1 1 1   20   19    9 o 36.58340 1.520730   23.35768   293.3   13.41218 1.112669          ?        ? 
1 1 1   20   19   10 o 8.827883 3.620947   10.35186   209.9  0.2706493 1.022453          ?        ? 
1 1 1   20   19   11 o 70.17181 1.092803   95.86780    46.6   49.31832 1.533679          ?        ? 
1 1 1   20   19   12 o 12.62496 3.014690   11.44801   109.0   1.684040 0.7518036          ?        ? 
1 1 1   20   19   13 o 26.16047 2.126624   33.78751    16.9   6.916593 1.112669          ?        ? 
1 1 1   20   19   14 o 51.57624 1.545114   70.26384   113.7   26.79428 1.593824          ?        ? 
1 1 1   20   19   15 o 31.53459 2.384060   40.64828   290.0   10.16438 1.503607          ?        ? 
1 1 1   20   19   16 o 33.51131 2.288301   36.94785     4.1   11.54770 1.533679          ?        ? 
1 1 1   20   19   17 o 9.959335 4.255467   15.09678   184.1  0.3007214 1.503607          ?        ? 
1 1 1   20   19   18 o 10.82194 4.464985   8.986530   206.0  0.8720922 1.563751          ?        ? 
1 1 1   20   19   19 o 8.706998 3.886249   14.27033   192.8   0.000000 1.383319          ?        ? 
1 1 1   20   20    0 o 59.12568 1.834900   47.29755   180.0   35.09419 2.165194   35.09419 2.165194 
1 1 1   20   20    1 o 38.04766 1.462205   58.76421   297.8   14.49477 1.112669          ?        ? 
1 1 1   20   20    2 o 76.94176 1.426577   83.99017   241.1   59.27220 2.195267          ?        ? 
1 1 1   20   20    3 o 72.03767 1.168861   71.79762   151.3   51.93459 1.684040          ?        ? 
1 1 1   20   20    4 o 105.0117 1.217070   83.92176    31.2   110.3648 2.556132          ?        ? 
1 1 1   20   20    5 o 34.26022 1.711626   46.02677    17.5   11.75821 1.172814          ?        ? 
1 1 1   20   20    6 o 97.17180 1.222422   114.8220   141.6   94.51675 2.375700          ?        ? 
1 1 1   20   20    7 o 72.23956 1.165594   78.32878    57.5   52.23531 1.684040          ?        ? 
1 1 1   20   20    8 o 76.04222 1.146853   93.30539   294.9   57.88888 1.744184          ?        ? 
1 1 1   20   20    9 o 55.04389 1.229243   51.41036   119.8   30.34279 1.353247          ?        ? 
1 1 1   20   20   10 o 12.01359 3.668448   14.63355    46.3   1.473535 0.9623086          ?        ? 
1 1 1   20   20   11 o 21.01727 2.217786   37.86052   150.7   4.450677 0.9322364          ?        ? 
1 1 1   20   20   12 o 39.85453 1.245004   46.37119   158.4   15.93824 0.9923807          ?        ? 
1 1 1   20   20   13 o 32.59971 1.291453   43.86205    15.8   10.67561 0.8420200          ?        ? 
1 1 1   20   20   14 o 34.25136 1.185278   40.01724    57.2   11.78828 0.8119479          ?        ? 
1 1 1   20   20   15 o 41.13451 1.864225   45.87805   252.1   17.20127 1.533679          ?        ? 
1 1 1   20   20   16 o 11.26662 4.060482   13.17009    80.5   1.263030 1.172814          ?        ? 
1 1 1   20   20   17 o 23.10135 3.319458   27.97858   143.9   5.773852 1.533679          ?        ? 
1 1 1   20   20   18 f 10.95877 4.454758   23.71146    64.8   1.052525 1.533679          ?        ? 
1 1 1   20   21    0 o 44.81894 2.259953   15.26086     0.0   20.26863 2.014834   20.26863 2.014834 
1 1 1   20   21    1 f 60.98795 1.282017   69.68285    64.2   37.22932 1.563751          ?        ? 
1 1 1   20   21    2 o 128.0973 1.349871   131.1438   118.3   164.2541 3.458297          ?        ? 
1 1 1   20   21    3 o 10.84903 4.081737   25.91441   304.1  0.8720922 1.202886          ?        ? 
1 1 1   20   21    4 o 69.84151 1.399375   87.25303   227.5   48.83716 1.954689          ?        ? 
1 1 1   20   21    5 o 101.9788 1.282755   116.3067   271.6   104.1098 2.616277          ?        ? 
1 1 1   20   21    6 o 43.32322 1.422976   68.74632   197.9   18.79509 1.232958          ?        ? 
1 1 1   20   21    7 o 44.27032 1.562354   56.42335   228.5   19.63711 1.383319          ?        ? 
1 1 1   20   21    8 o 53.63142 1.289653   47.92989    43.0   28.80912 1.383319          ?        ? 
1 1 1   20   21    9 o 44.63628 1.381116   67.08060   186.7   19.96791 1.232958          ?        ? 
1 1 1   20   21   10 o 61.32331 1.225967   59.81628   168.0   37.68040 1.503607          ?        ? 
1 1 1   20   21   11 o 56.78564 1.218018   57.58107    58.0   32.32756 1.383319          ?        ? 
1 1 1   20   21   12 o 21.72981 2.352650   28.37279   235.4   4.781471 1.022453          ?        ? 
1 1 1   20   21   13 o 36.94538 1.261642   51.14879   351.4   13.71290 0.9322364          ?        ? 
1 1 1   20   21   14 o 40.33422 1.230197   40.80382    86.9   16.35925 0.9923807          ?        ? 
1 1 1   20   21   15 o 49.64842 1.120549   56.32328   110.7   24.80952 1.112669          ?        ? 
1 1 1   20   21   16 o 7.989895 3.167504   8.463563   293.2  0.4210100 0.7518036          ?        ? 
1 1 1   20   21   17 o 7.498346 3.592433   6.680544     2.9  -1.684040 1.533679          ?        ? 
1 1 1   20   21   18 o 16.91012 4.336457   20.59009    59.0   3.608657 1.473535          ?        ? 
1 1 1   20   22    0 o 129.5839 1.869010   144.8894    -0.0   168.1935 4.841615   168.1935 4.841615 
1 1 1   20   22    1 o 83.58138 1.205312   88.31137     3.9   69.91774 2.014834          ?        ? 
1 1 1   20   22    2 o 49.71811 1.421404   35.22791   200.4   24.74938 1.413391          ?        ? 
1 1 1   20   22    3 o 43.63026 1.550812   90.50954   173.8   19.06574 1.353247          ?        ? 
1 1 1   20   22    4 o 114.9116 1.439340   126.1701   236.9   132.2272 3.307936          ?        ? 
1 1 1   20   22    5 o 56.28099 1.522816   61.83480   356.9   31.72611 1.714112          ?        ? 
1 1 1   20   22    6 o 37.87607 1.587923   36.15840    20.6   14.37449 1.202886          ?        ? 
1 1 1   20   22    7 o 94.21329 1.260809   88.29350   252.3   88.89326 2.375700          ?        ? 
1 1 1   20   22    8 o 68.32773 1.254331   70.46387   169.5   46.76218 1.714112          ?        ? 
1 1 1   20   22    9 o 60.78514 1.261558   66.93478   195.6   37.01881 1.533679          ?        ? 
1 1 1   20   22   10 o 68.05497 1.281453   68.30570   291.9   46.43139 1.744184          ?        ? 
1 1 1   20   22   11 o 50.84870 1.301090   68.58340   157.1   25.95226 1.323174          ?        ? 
1 1 1   20   22   12 o 39.91701 1.506733   39.39525   205.1   16.02845 1.202886          ?        ? 
1 1 1   20   22   13 o 30.22601 1.492365   50.48747    43.9   9.202076 0.9021643          ?        ? 
1 1 1   20   22   14 o 30.88400 1.460569   53.24619    60.8   9.623086 0.9021643          ?        ? 
1 1 1   20   22   15 o 15.33453 2.852068   23.76280   135.6   2.526060 0.8420200          ?        ? 
1 1 1   20   22   16 o 16.91189 2.489432   8.190447   270.1   2.977142 0.8420200          ?        ? 
1 1 1   20   22   17 o 17.62533 1.706189   20.00862    74.5   3.187647 0.6014429          ?        ? 
1 1 1   20   22   18 o 20.78909 1.880495   22.37276   108.2   4.510822 0.7818757          ?        ? 
1 1 1   20   23    0 o 83.12454 1.738199   91.07938   360.0   69.25615 2.886926   69.25615 2.886926 
1 1 1   20   23    1 o 60.01346 1.302834   84.53757   176.0   36.05650 1.563751          ?        ? 
1 1 1   20   23    2 o 44.28407 1.426054   64.92302    85.9   19.63711 1.263030          ?        ? 
1 1 1   20   23    3 o 118.4192 1.371311   165.5624   194.1   140.4068 3.247792          ?        ? 
1 1 1   20   23    4 o 46.45065 1.715610   22.17784    22.2   21.62187 1.593824          ?        ? 
1 1 1   20   23    5 o 40.50878 1.744549   50.07767    30.0   16.44946 1.413391          ?        ? 
1 1 1   20   23    6 o 35.81702 1.889111   32.70856   170.7   12.87088 1.353247          ?        ? 
1 1 1   20   23    7 o 31.05767 1.984949   41.93612   177.3   9.683230 1.232958          ?        ? 
1 1 1   20   23    8 o 54.17263 1.332281   64.14007    73.5   29.41056 1.443463          ?        ? 
1 1 1   20   23    9 o 20.42704 3.312390   24.80183    47.2   4.240172 1.353247          ?        ? 
1 1 1   20   23   10 o 52.37581 1.291862   80.26292   293.2   27.51601 1.353247          ?        ? 
1 1 1   20   23   11 o 16.44213 3.224185   11.89350   135.2   2.856854 1.022453          ?        ? 
1 1 1   20   23   12 o 16.04328 3.206205   23.69917   268.2   2.736565 0.9923807          ?        ? 
1 1 1   20   23   13 o 11.38825 3.755613   10.64233   232.1   1.323174 0.9923807          ?        ? 
1 1 1   20   23   14 o 9.249248 3.561198   13.12494   179.2  0.6615872 0.9322364          ?        ? 
1 1 1   20   23   15 o 27.79234 1.785349   31.26559   158.4   7.878902 0.9923807          ?        ? 
1 1 1   20   23   16 o 20.53180 2.343459   23.16817    37.3   4.390533 0.9623086          ?        ? 
1 1 1   20   23   17 o 5.612969 2.575329   14.51756   311.6 -0.3909379 0.6615872          ?        ? 
1 1 1   20   24    0 o 22.72835 3.781291   2.573955   360.0   5.533275 1.593824   5.533275 1.593824 
1 1 1   20   24    1 o 66.55972 1.332831   86.42130   169.6   44.35641 1.774257          ?        ? 
1 1 1   20   24    2 o 57.99444 1.400044   73.64379    38.2   33.68080 1.623896          ?        ? 
1 1 1   20   24    3 o 26.58839 2.262051   6.400299   291.7   7.097026 1.202886          ?        ? 
1 1 1   20   24    4 o 28.96283 2.128518   16.64824   315.6   8.420200 1.232958          ?        ? 
1 1 1   20   24    5 o 58.46439 1.491664   49.43346   224.5   34.25217 1.744184          ?        ? 
1 1 1   20   24    6 o 50.43222 1.639793   62.04269    87.4   25.50118 1.653968          ?        ? 
1 1 1   20   24    7 o 19.45575 3.688791   7.159554   288.2   3.969523 1.383319          ?        ? 
1 1 1   20   24    8 o 39.78740 1.511642   42.79703    90.3   15.87809 1.202886          ?        ? 
1 1 1   20   24    9 o 49.77409 1.298971   64.81301    93.0   24.83959 1.293102          ?        ? 
1 1 1   20   24   10 o 14.14927 3.910422   13.05615   300.6   2.135122 1.142741          ?        ? 
1 1 1   20   24   11 o 34.19294 1.758968   47.71621    20.6   11.78828 1.202886          ?        ? 
1 1 1   20   24   12 o 11.33236 3.867748   5.998681   145.9   1.263030 1.052525          ?        ? 
1 1 1   20   24   13 o 14.56397 3.623710   29.06406   340.5   2.315555 1.052525          ?        ? 
1 1 1   20   24   14 o 15.46959 3.304389   22.80525    23.2   2.616277 0.9923807          ?        ? 
1 1 1   20   24   15 o 9.492032 3.670205   18.61682   335.0  0.7217315 0.9923807          ?        ? 
1 1 1   20   24   16 o 14.68250 2.657821   13.56830   165.3   2.345627 0.7518036          ?        ? 
1 1 1   20   24   17 o 8.488502 3.167998   3.376567   334.5  0.6916593 0.7217315          ?        ? 
1 1 1   20   25    0 o 56.95016 1.772724   56.15024   180.0   32.56813 2.014834   32.56813 2.014834 
1 1 1   20   25    1 o 18.41128 3.723573   41.26013   184.4   3.548513 1.323174          ?        ? 
1 1 1   20   25    2 o 81.15398 1.259893   88.46180   271.0   65.94821 2.044906          ?        ? 
1 1 1   20   25    3 o 125.9999 1.348475   135.5784    69.8   159.0215 3.398152          ?        ? 
1 1 1   20   25    4 o 45.23632 1.528991   59.33649     8.5   20.50920 1.383319          ?        ? 
1 1 1   20   25    5 o 21.84403 2.891018   31.56055   323.6   4.811543 1.263030          ?        ? 
1 1 1   20   25    6 o 15.57030 4.302072   13.21020   112.4   2.556132 1.383319          ?        ? 
1 1 1   20   25    7 o 26.29415 2.687653   29.93414   202.9   6.976738 1.413391          ?        ? 
1 1 1   20   25    8 o 84.88731 1.363900   93.04722   291.1   72.26337 2.315555          ?        ? 
1 1 1   20   25    9 o 7.811177 3.485933   7.291062   332.5 -0.4210100 1.112669          ?        ? 
1 1 1   20   25   10 o 34.29609 1.753677   39.82706   288.0   11.84843 1.202886          ?        ? 
1 1 1   20   25   11 o 38.91111 1.545684   50.10919   311.2   15.24658 1.202886          ?        ? 
1 1 1   20   25   12 f 9.141888 3.733838   10.41054   303.4  0.3909379 1.082597          ?        ? 
1 1 1   20   25   13 o 24.65472 2.195517   31.28609   282.5   6.224934 1.082597          ?        ? 
1 1 1   20   25   14 o 18.45605 2.851436   18.50224    77.7   3.578585 1.052525          ?        ? 
1 1 1   20   25   15 o 18.36377 2.210733   24.92146   135.4   3.488369 0.8119479          ?        ? 
1 1 1   20   25   16 o 50.31943 1.075725   51.27105    84.1   25.59139 1.082597          ?        ? 
1 1 1   20   25   17 o 18.36247 2.210890   23.66698   328.4   3.578585 0.8119479          ?        ? 
1 1 1   20   26    0 o 44.40256 2.212787   52.48017     0.0   19.90776 1.954689   19.90776 1.954689 
1 1 1   20   26    1 o 146.9888 1.544639   162.9676   144.6   216.5495 4.540894          ?        ? 
1 1 1   20   26    2 o 28.56845 2.473692   34.46891   189.5   8.209695 1.413391          ?        ? 
1 1 1   20   26    3 o 56.37547 1.440251   64.48157   270.4   31.84640 1.623896          ?        ? 
1 1 1   20   26    4 o 45.75826 1.511551   15.49547   196.6   20.99036 1.383319          ?        ? 
1 1 1   20   26    5 o 74.89652 1.264775   76.39880   170.6   56.20484 1.894545          ?        ? 
1 1 1   20   26    6 f 36.42623 1.774961   64.41878   165.0   13.32196 1.293102          ?        ? 
1 1 1   20   26    7 f 28.96894 2.128068   56.07215   138.8   8.450273 1.232958          ?        ? 
1 1 1   20   26    8 o 42.12486 1.820397   69.28715   338.2   17.86285 1.533679          ?        ? 
1 1 1   20   26    9 o 6.706507 3.205476   7.428626   334.2  -1.563751 1.202886          ?        ? 
1 1 1   20   26   10 o 58.22935 1.187819   67.23233   156.5   34.04167 1.383319          ?        ? 
1 1 1   20   26   11 o 6.902479 3.231719   17.52088   332.9  -1.022453 1.112669          ?        ? 
1 1 1   20   26   12 o 38.10531 1.617830   40.47171   320.3   14.67521 1.232958          ?        ? 
1 1 1   20   26   13 o 24.64681 2.379241   22.31038    81.0   6.255006 1.172814          ?        ? 
1 1 1   20   26   14 o 12.64680 3.961595   18.71392   359.7   1.774257 1.112669          ?        ? 
1 1 1   20   26   15 f 25.97419 1.736655   15.43464    20.4   6.916593 0.9021643          ?        ? 
1 1 1   20   26   16 o 25.97689 1.620710   28.72870   222.9   6.946666 0.8420200          ?        ? 
1 1 1   20   27    0 o 42.50755 2.169725   51.06404     0.0   18.25379 1.834401   18.25379 1.834401 
1 1 1   20   27    1 o 31.65567 2.232445   24.33261   232.9   10.07417 1.413391          ?        ? 
1 1 1   20   27    2 o 97.76956 1.322602   94.82939   288.7   95.77978 2.586205          ?        ? 
1 1 1   20   27    3 o 70.29857 1.347499   75.62975   328.4   49.52882 1.894545          ?        ? 
1 1 1   20   27    4 o 67.93631 1.327956   70.74343   129.0   46.25096 1.804329          ?        ? 
1 1 1   20   27    5 o 48.34817 1.586078   40.17040   243.1   23.45627 1.533679          ?        ? 
1 1 1   20   27    6 o 26.24605 2.348845   27.98659   351.8   6.946666 1.232958          ?        ? 
1 1 1   20   27    7 o 20.25399 3.117979   14.27847   164.2   4.180028 1.263030          ?        ? 
1 1 1   20   27    8 o 29.93705 2.109476   40.25867   120.3   9.051716 1.263030          ?        ? 
1 1 1   20   27    9 o 12.31423 4.325306   21.31929   146.9   1.443463 1.323174          ?        ? 
1 1 1   20   27   10 o 11.84055 4.127337   1.478703   118.8   1.353247 1.202886          ?        ? 
1 1 1   20   27   11 o 30.31281 1.984121   34.98674   189.4   9.322365 1.202886          ?        ? 
1 1 1   20   27   12 o 14.22321 3.972168   15.53414   210.6   2.255411 1.172814          ?        ? 
1 1 1   20   27   13 o 37.45433 1.605803   45.32674   248.1   14.25420 1.202886          ?        ? 
1 1 1   20   27   14 o 8.240873 3.283949   13.52117   229.9  0.4510822 0.8119479          ?        ? 
1 1 1   20   27   15 o 5.722605 2.717614   9.105312   187.3 -0.9021643 0.8420200          ?        ? 
1 1 1   20   27   16 o 19.33444 2.255282   26.95623   318.6   3.969523 0.8720922          ?        ? 
1 1 1   20   28    0 o 108.0543 1.851950   116.0919   180.0   117.1009 3.999595   117.1009 3.999595 
1 1 1   20   28    1 o 102.0592 1.325943   103.9435   300.3   104.3804 2.706493          ?        ? 
1 1 1   20   28    2 o 53.38045 1.464723   45.64874   350.6   28.56854 1.563751          ?        ? 
1 1 1   20   28    3 o 43.13771 1.638231   48.83675    87.8   18.67480 1.413391          ?        ? 
1 1 1   20   28    4 o 33.34185 2.029351   46.34526   159.7   11.18684 1.353247          ?        ? 
1 1 1   20   28    5 o 24.59452 2.445435   37.78334   138.3   6.104645 1.202886          ?        ? 
1 1 1   20   28    6 o 33.04728 1.956443   15.82111   257.5   11.00640 1.293102          ?        ? 
1 1 1   20   28    7 o 14.52684 4.010799   14.81502   133.7   2.255411 1.202886          ?        ? 
1 1 1   20   28    8 o 28.19659 2.293012   29.74535   355.2   8.059335 1.293102          ?        ? 
1 1 1   20   28    9 f 47.91415 1.569064   46.43423   262.0   23.12548 1.503607          ?        ? 
1 1 1   20   28   10 o 22.13708 3.192360   32.78671   327.4   5.082192 1.413391          ?        ? 
1 1 1   20   28   11 o 26.72288 2.250667   21.89337   270.0   7.307531 1.202886          ?        ? 
1 1 1   20   28   12 o 29.00756 2.021566   32.20810   142.6   8.600634 1.172814          ?        ? 
1 1 1   20   28   13 o 41.01777 1.649586   49.12862   250.9   17.11105 1.353247          ?        ? 
1 1 1   20   28   14 o 30.94178 1.457842   31.67561    41.2   9.743376 0.9021643          ?        ? 
1 1 1   20   28   15 o 8.928828 3.531140   6.842364    83.4  0.6615872 0.9322364          ?        ? 
1 1 1   20   29    0 o 66.74883 1.872945   60.10566     0.0   44.77742 2.495988   44.77742 2.495988 
1 1 1   20   29    1 o 20.29521 3.111646   37.00917   330.6   4.180028 1.263030          ?        ? 
1 1 1   20   29    2 o 44.05295 1.638327   56.43113    89.4   19.48675 1.443463          ?        ? 
1 1 1   20   29    3 o 9.184130 3.959834   1.300906   282.9      -0.09 1.323174          ?        ? 
1 1 1   20   29    4 o 26.71462 2.532783   18.47773   265.8   7.217315 1.353247          ?        ? 
1 1 1   20   29    5 o 42.10519 1.642694   47.96597   117.7   17.83278 1.383319          ?        ? 
1 1 1   20   29    6 o 63.87788 1.294633   78.82750     1.6   40.95826 1.653968          ?        ? 
1 1 1   20   29    7 o 53.74358 1.342917   63.40614     0.7   29.01962 1.443463          ?        ? 
1 1 1   20   29    8 o 36.19868 1.827655   31.27748   132.0   13.23174 1.323174          ?        ? 
1 1 1   20   29    9 o 44.50468 1.520342   42.88587    68.7   19.96791 1.353247          ?        ? 
1 1 1   20   29   10 o 25.81549 2.446265   22.97356   301.4   6.826377 1.263030          ?        ? 
1 1 1   20   29   11 o 45.20246 1.363817   48.77670    47.5   20.62949 1.232958          ?        ? 
1 1 1   20   29   12 o 18.29971 3.493923   15.31991   280.0   3.698874 1.232958          ?        ? 
1 1 1   20   29   13 o 28.99133 1.659649   17.79413    34.3   8.570561 0.9623086          ?        ? 
1 1 1   20   29   14 o 35.50402 1.524612   36.05672   302.8   12.87088 1.082597          ?        ? 
1 1 1   20   29   15 o 11.49265 3.694944   11.64919   115.3   1.563751 0.9623086          ?        ? 
1 1 1   20   30    0 o 11.84203 5.903737   19.92564   360.0   2.135122 1.684040   2.135122 1.684040 
1 1 1   20   30    1 o 10.96675 4.201638   14.07563   265.2  0.8720922 1.293102          ?        ? 
1 1 1   20   30    2 o 34.28426 2.017425   33.98511   186.6   11.84843 1.383319          ?        ? 
1 1 1   20   30    3 f 32.98670 2.005618   14.96925    62.4   10.97633 1.323174          ?        ? 
1 1 1   20   30    4 o 63.51649 1.349344   67.41976   102.0   40.50718 1.714112          ?        ? 
1 1 1   20   30    5 o 48.92471 1.475188   69.74619   179.9   24.05772 1.443463          ?        ? 
1 1 1   20   30    6 o 7.351872 3.442308   13.34181   140.2  -1.172814 1.263030          ?        ? 
1 1 1   20   30    7 o 57.25307 1.365649   69.49012    45.1   32.95907 1.563751          ?        ? 
1 1 1   20   30    8 o 35.58894 1.816719   35.89019     7.2   12.81073 1.293102          ?        ? 
1 1 1   20   30    9 o 27.06947 2.388489   27.72688   186.4   7.487964 1.293102          ?        ? 
1 1 1   20   30   10 o 11.49251 4.115148   2.638141   231.2   1.293102 1.202886          ?        ? 
1 1 1   20   30   11 o 13.75778 4.015053   13.82462   133.3   2.135122 1.172814          ?        ? 
1 1 1   20   30   12 o 45.83245 1.443491   50.66397    78.0   21.29108 1.323174          ?        ? 
1 1 1   20   30   13 o 17.32429 2.690547   27.92682    97.6   3.187647 0.9322364          ?        ? 
1 1 1   20   30   14 o 25.03635 1.921823   29.22872   131.7   6.525656 0.9623086          ?        ? 
1 1 1   20   31    0 o 14.51077 6.623098   1.802288   360.0   3.187647 2.074978   3.187647 2.074978 
1 1 1   20   31    1 o 45.92860 1.702372   56.45882    50.6   21.23093 1.563751          ?        ? 
1 1 1   20   31    2 o 23.95763 2.698728   29.37933     7.2   5.833996 1.293102          ?        ? 
1 1 1   20   31    3 o 35.34586 1.914293   54.09102   285.4   12.60023 1.353247          ?        ? 
1 1 1   20   31    4 o 21.39873 3.091712   30.05800    29.2   4.691255 1.323174          ?        ? 
1 1 1   20   31    5 o 37.47027 1.966273   48.41240   155.6   14.19405 1.473535          ?        ? 
1 1 1   20   31    6 f 50.51509 1.458510   42.28870   213.2   25.68161 1.473535          ?        ? 
1 1 1   20   31    7 o 69.53415 1.275817   52.11145   208.4   48.62666 1.774257          ?        ? 
1 1 1   20   31    8 o 50.82451 1.567968   49.15746   127.2   26.07255 1.593824          ?        ? 
1 1 1   20   31    9 o 31.31006 2.064995   33.16152    48.6   10.01402 1.293102          ?        ? 
1 1 1   20   31   10 o 21.06083 2.998528   23.04848   212.0   4.661182 1.263030          ?        ? 
1 1 1   20   31   11 o 18.05261 3.541131   22.81440   309.3   3.608657 1.232958          ?        ? 
1 1 1   20   31   12 o 6.415395 3.099185   6.200152   307.3  -1.653968 1.202886          ?        ? 
1 1 1   20   31   13 o 6.836730 3.109263   9.656969    44.4 -0.3909379 0.9322364          ?        ? 
1 1 1   20   31   14 o 24.59413 1.895242   22.62564   195.1   6.315150 0.9322364          ?        ? 
1 1 1   20   32    0 o 29.02396 3.669693   25.60007     0.0   8.961499 2.074978   8.961499 2.074978 
1 1 1   20   32    1 o 42.37307 1.774249   55.93708    55.0   18.10343 1.503607          ?        ? 
1 1 1   20   32    2 o 28.26401 2.447138   19.49823   136.9   8.119479 1.383319          ?        ? 
1 1 1   20   32    3 o 18.77175 3.817257   17.80000   172.6   3.789090 1.383319          ?        ? 
1 1 1   20   32    4 o 66.49447 1.334138   59.83246    29.2   44.44663 1.774257          ?        ? 
1 1 1   20   32    5 o 29.13779 2.270547   33.47459    11.6   8.630706 1.323174          ?        ? 
1 1 1   20   32    6 o 23.51987 2.748957   30.40912   216.0   5.683635 1.293102          ?        ? 
1 1 1   20   32    7 o 33.82866 2.089044   31.03601    22.0   11.63792 1.413391          ?        ? 
1 1 1   20   32    8 o 57.02560 1.397463   49.86736   257.4   32.83878 1.593824          ?        ? 
1 1 1   20   32    9 o 26.10897 2.591536   26.89825   219.0   7.066954 1.353247          ?        ? 
1 1 1   20   32   10 o 27.17524 2.489852   22.06818    64.0   7.668397 1.353247          ?        ? 
1 1 1   20   32   11 o 15.93943 3.895292   12.71882    94.5   2.916998 1.232958          ?        ? 
1 1 1   20   32   12 o 12.20229 4.231576   6.573572   277.1   1.684040 1.263030          ?        ? 
1 1 1   20   32   13 o 11.94414 3.532888   16.99531    51.5   1.684040 0.9021643          ?        ? 
1 1 1   20   33    0 o 7.789819 5.033284   10.62931   180.0  0.1804329 1.774257  0.1804329 1.774257 
1 1 1   20   33    1 o 27.43975 2.739834   32.26407   194.1   7.698469 1.503607          ?        ? 
1 1 1   20   33    2 o 47.25137 1.559251   51.85990   273.9   22.49397 1.473535          ?        ? 
1 1 1   20   33    3 o 33.99303 1.946244   43.15834   357.7   11.69806 1.323174          ?        ? 
1 1 1   20   33    4 o 55.19131 1.498395   64.05055   302.8   30.70366 1.653968          ?        ? 
1 1 1   20   33    5 o 32.25059 2.191263   32.61540   324.3   10.58539 1.413391          ?        ? 
1 1 1   20   33    6 o 35.15618 2.010160   37.39999   319.6   12.57016 1.413391          ?        ? 
1 1 1   20   33    7 o 30.47735 2.269421   23.53919   268.5   9.532870 1.383319          ?        ? 
1 1 1   20   33    8 o 16.28143 3.919968   10.86829   279.7   2.977142 1.263030          ?        ? 
1 1 1   20   33    9 o 43.37682 1.629200   44.35981   291.5   19.12588 1.413391          ?        ? 
1 1 1   20   33   10 o 13.74167 4.323218   21.25565     5.1   2.165194 1.323174          ?        ? 
1 1 1   20   33   11 o 10.34708 4.104428   5.346369   240.7  0.9021643 1.263030          ?        ? 
1 1 1   20   33   12 o 10.85367 3.752142   5.473695   207.1   1.323174 0.9923807          ?        ? 
1 1 1   20   33   13 o 12.59151 3.699293   19.49446   328.0   1.924617 0.9923807          ?        ? 
1 1 1   20   34    0 o 25.99267 3.519500   32.53886     0.0   7.066954 1.804329   7.066954 1.804329 
1 1 1   20   34    1 o 8.758239 3.881141   7.546861   189.1 -0.3307936 1.353247          ?        ? 
1 1 1   20   34    2 o 51.02147 1.620855   55.33367   306.6   26.28305 1.653968          ?        ? 
1 1 1   20   34    3 o 28.43327 2.485452   32.77279    42.2   8.269840 1.413391          ?        ? 
1 1 1   20   34    4 o 35.45542 2.035603   38.46349    27.0   12.78066 1.443463          ?        ? 
1 1 1   20   34    5 o 62.66834 1.439586   62.31279    34.9   39.66516 1.804329          ?        ? 
1 1 1   20   34    6 o 39.65405 1.933825   47.01669   346.4   16.02845 1.533679          ?        ? 
1 1 1   20   34    7 o 14.67619 4.064298   9.800622   350.5   2.435844 1.232958          ?        ? 
1 1 1   20   34    8 o 26.69505 2.478314   17.99180   275.6   7.397748 1.323174          ?        ? 
1 1 1   20   34    9 o 18.79770 3.732123   26.56364   247.9   3.969523 1.353247          ?        ? 
1 1 1   20   34   10 o 18.14260 3.771857   16.35983   251.3   3.789090 1.323174          ?        ? 
1 1 1   20   34   11 o 35.22117 2.006451   32.05341   268.9   12.90095 1.413391          ?        ? 
1 1 1   20   34   12 o 9.877913 3.830510   6.775895   288.0  0.9623086 1.082597          ?        ? 
1 1 1   20   35    0 o 16.57130 6.168409   25.52959     0.0   3.879307 1.894545   3.879307 1.894545 
1 1 1   20   35    1 o 17.57715 4.305419   12.21788   164.7   3.458297 1.503607          ?        ? 
1 1 1   20   35    2 o 17.86134 4.049217   25.44386   113.4   3.548513 1.413391          ?        ? 
1 1 1   20   35    3 o 25.01328 2.945506   21.11893    29.3   6.525656 1.473535          ?        ? 
1 1 1   20   35    4 o 23.36226 2.831863   36.19529   347.2   5.683635 1.323174          ?        ? 
1 1 1   20   35    5 o 14.69919 4.320268   15.52471   336.9   2.435844 1.353247          ?        ? 
1 1 1   20   35    6 o 18.67500 3.673511   19.01922   240.8   3.879307 1.323174          ?        ? 
1 1 1   20   35    7 o 15.61953 4.160054   16.59634   258.3   2.796710 1.323174          ?        ? 
1 1 1   20   35    8 o 45.06813 1.768238   42.15201   119.4   20.74978 1.593824          ?        ? 
1 1 1   20   35    9 o 9.730542 4.091941   7.268379   262.4  0.4811543 1.353247          ?        ? 
1 1 1   20   35   10 o 14.25982 4.291181   16.02147   331.1   2.465916 1.323174          ?        ? 
1 1 1   20   35   11 o 11.74740 4.260674   14.34783   342.0   1.623896 1.293102          ?        ? 
1 1 1   20   36    0 o 7.923127 5.089415   18.58370   360.0  0.3608657 1.774257  0.3608657 1.774257 
1 1 1   20   36    1 o 41.87871 1.974712   43.07264    23.1   17.89293 1.653968          ?        ? 
1 1 1   20   36    2 o 17.90856 4.114213   13.92721   320.6   3.608657 1.443463          ?        ? 
1 1 1   20   36    3 o 37.86237 1.985622   39.26084   209.6   14.64513 1.503607          ?        ? 
1 1 1   20   36    4 o 8.256046 3.752450   4.940382   326.4 -0.5713707 1.353247          ?        ? 
1 1 1   20   36    5 o 19.52739 3.832600   29.91847    48.3   4.270245 1.443463          ?        ? 
1 1 1   20   36    6 o 11.06662 4.247224   13.86612    40.3   1.082597 1.323174          ?        ? 
1 1 1   20   36    7 o 22.31052 3.100149   21.13555   354.6   5.322770 1.383319          ?        ? 
1 1 1   20   36    8 o 16.77645 4.142183   17.35388   264.6   3.338008 1.383319          ?        ? 
1 1 1   20   36    9 o 37.87755 2.143612   43.74392   185.2   14.97593 1.623896          ?        ? 
1 1 1   20   36   10 o 16.73263 4.075769   22.04758   338.5   3.458297 1.353247          ?        ? 
1 1 1   20   37    0 o 9.832242 5.810737   20.86308   180.0   1.413391 1.924617   1.413391 1.924617 
1 1 1   20   37    1 o 12.18157 4.567381   18.46651   318.5   1.443463 1.503607          ?        ? 
1 1 1   20   37    2 o 32.74073 2.066610   31.08387   245.9   11.00640 1.353247          ?        ? 
1 1 1   20   37    3 o 8.136580 3.761321   13.43817   238.3 -0.9021643 1.443463          ?        ? 
1 1 1   20   37    4 o 32.58683 2.399361   35.11538   324.8   11.00640 1.563751          ?        ? 
1 1 1   20   37    5 o 7.347304 3.457505   4.369344   222.6  -1.202886 1.323174          ?        ? 
1 1 1   20   37    6 o 36.19438 2.118670   33.83630   229.0   13.56254 1.533679          ?        ? 
1 1 1   20   37    7 o 19.55672 3.747220   9.093805   197.9   4.390533 1.413391          ?        ? 
1 1 1   20   37    8 o 15.30343 4.388865   9.099368    74.2   2.886926 1.413391          ?        ? 
1 1 1   20   37    9 o 22.97175 3.207277   16.45651   267.0   5.924213 1.473535          ?        ? 
1 1 1   20   38    0 o 5.077112 3.706114   1.128612   180.0  -3.398152 1.954689  -3.398152 1.954689 
1 1 1   20   38    1 o 29.89031 2.666121   32.67998   238.8   9.352437 1.593824          ?        ? 
1 1 1   20   38    2 o 11.54156 4.367820   8.563946   139.2   1.263030 1.383319          ?        ? 
1 1 1   20   38    3 o 25.81614 2.679174   32.99107   315.7   7.006810 1.383319          ?        ? 
1 1 1   20   38    4 o 28.56869 2.526303   27.96186   325.0   8.570561 1.443463          ?        ? 
1 1 1   20   38    5 o 13.23147 4.482015   20.55344   153.7   2.044906 1.413391          ?        ? 
1 1 1   20   38    6 o 9.753062 4.120967   8.537991   357.5  0.4811543 1.383319          ?        ? 
1 1 1   20   38    7 o 28.74381 2.563221   24.49145    48.1   8.841210 1.473535          ?        ? 
1 1 1   20   38    8 o 17.36076 4.268167   16.35638    27.6   3.789090 1.473535          ?        ? 
1 1 1   20   39    0 o 33.61290 3.184316   28.68909   180.0   12.05893 2.105050   12.05893 2.105050 
1 1 1   20   39    1 o 27.06772 2.833041   18.96027    29.7   7.818758 1.533679          ?        ? 
1 1 1   20   39    2 o 11.24393 4.410130   8.553298   262.7   1.172814 1.443463          ?        ? 
1 1 1   20   39    3 o 17.89762 4.115921   18.19372   214.4   3.789090 1.443463          ?        ? 
1 1 1   20   39    4 o 21.88253 3.504346   20.20423   128.3   5.322770 1.533679          ?        ? 
1 1 1   20   39    5 o 7.764782 3.609476   7.315770   164.8 -0.7818757 1.353247          ?        ? 
1 1 1   20   39    6 o 11.53263 4.433224   9.457563   141.9   1.473535 1.443463          ?        ? 
1 1 1   20   39    7 o 11.08120 4.323195   14.45563   181.2   1.323174 1.383319          ?        ? 
1 1 1   20   40    0 o 46.11910 2.626023   46.10144   180.0   22.16317 2.405771   22.16317 2.405771 
1 1 1   20   40    1 o 10.44496 4.372543   9.449746   190.7  0.7217315 1.533679          ?        ? 
1 1 1   20   40    2 o 53.63773 1.653926   50.32800   100.1   29.56092 1.774257          ?        ? 
1 1 1   20   40    3 o 26.21324 2.868031   30.45384   316.0   7.487964 1.503607          ?        ? 
1 1 1   20   40    4 o 9.641335 4.230869   7.079183   260.1  0.3007214 1.563751          ?        ? 
1 1 1   20   40    5 o 13.06529 4.566796   12.69829   182.7   2.165194 1.473535          ?        ? 
1 1 1   20   40    6 o 22.10800 3.400596   25.55858   171.0   5.623491 1.503607          ?        ? 
1 1 1   20   41    0 o 19.76904 6.656343   4.909146     0.0   5.864068 2.345627   5.864068 2.345627 
1 1 1   20   41    1 o 12.87458 4.643007   16.77213   270.5   2.074978 1.533679          ?        ? 
1 1 1   20   41    2 f 9.877985 4.216447   6.963059   333.1  0.6014429 1.473535          ?        ? 
1 1 1   20   41    3 o 14.16288 4.668840   13.20682   224.5   2.646349 1.533679          ?        ? 
1 1 1   20   41    4 o 15.38512 4.779253   19.02777   352.4   3.217719 1.623896          ?        ? 
1 1 1   21    0    1 o 96.21265 1.422841   114.5326    90.0   92.65228 2.736565   92.65228 2.736565 
1 1 1   21    0    2 o 70.46671 1.217068   130.2240    90.0   49.70926 1.714112   49.70926 1.714112 
1 1 1   21    0    3 o 58.56321 1.156378   63.78420    90.0   34.34239 1.353247   34.34239 1.353247 
1 1 1   21    0    4 o 98.26994 1.377677   73.66177   270.0   96.65187 2.706493   96.65187 2.706493 
1 1 1   21    0    5 o 118.3467 1.423434   188.0741    90.0   140.1663 3.368080   140.1663 3.368080 
1 1 1   21    0    6 o 53.31918 1.185709   63.24163    90.0   28.47832 1.263030   28.47832 1.263030 
1 1 1   21    0    7 o 30.25317 1.247107   12.73716    90.0   9.202076 0.7518036   9.202076 0.7518036 
1 1 1   21    0    8 o 36.78017 1.023776   67.29514   270.0   13.56254 0.7518036   13.56254 0.7518036 
1 1 1   21    0    9 o 54.51905 1.131846   66.66309   270.0   29.77142 1.232958   29.77142 1.232958 
1 1 1   21    0   10 o 78.92561 1.277161   94.82108    90.0   62.36963 2.014834   62.36963 2.014834 
1 1 1   21    0   11 o 42.83961 2.545778   41.24994    90.0   18.58459 2.165194   18.58459 2.165194 
1 1 1   21    0   12 o 105.8077 2.333087   173.8329   270.0   112.3495 4.931832   112.3495 4.931832 
1 1 1   21    0   13 o 61.94091 4.040528   87.79210   270.0   39.15393 4.961904   39.15393 4.961904 
1 1 1   21    0   14 x        ?      ?   95.65531    90.0          ?        ?          ?        ? 
1 1 1   21    0   15 x        ?      ?   123.6076   270.0          ?        ?          ?        ? 
1 1 1   21    0   16 x        ?      ?   31.34163   270.0          ?        ?          ?        ? 
1 1 1   21    0   17 o 22.69668 6.985405   34.09946   270.0   6.766232 2.766637   6.766232 2.766637 
1 1 1   21    0   18 o 13.56901 2.903593   11.04596   270.0   2.105050 0.6916593   2.105050 0.6916593 
1 1 1   21    0   19 o 36.27312 1.372204   47.03222    90.0   13.29189 0.9923807   13.29189 0.9923807 
1 1 1   21    0   20 f 36.11482 1.462389   45.46712    90.0   13.23174 1.052525   13.23174 1.052525 
1 1 1   21    0   21 o 29.28852 1.863667   41.42557    90.0   8.871283 1.082597   8.871283 1.082597 
1 1 1   21    1    0 o 100.3153 1.379555   173.0410     0.0   100.7116 2.766637   100.7116 2.766637 
1 1 1   21    1    1 o 157.5406 1.183487   241.9918   272.6   248.2756 3.728946          ?        ? 
1 1 1   21    1    2 o 95.31989 0.9149111   87.43657   323.7   90.87802 1.744184          ?        ? 
1 1 1   21    1    3 o 124.5037 1.014452   151.6580   217.1   155.0520 2.526060          ?        ? 
1 1 1   21    1    4 o 37.46971 1.003215   67.54802    15.4   14.04369 0.7518036          ?        ? 
1 1 1   21    1    5 o 100.6548 0.9411100   168.0398   336.8   101.3431 1.894545          ?        ? 
1 1 1   21    1    6 o 86.20886 0.8546309   135.0377   291.0   74.33834 1.473535          ?        ? 
1 1 1   21    1    7 o 25.94823 1.043036   75.52203    64.3   6.736160 0.5412986          ?        ? 
1 1 1   21    1    8 o 9.905105 2.183931   47.20827    53.4   1.022453 0.4210100          ?        ? 
1 1 1   21    1    9 o 68.39442 0.7694525   78.42472    52.1   46.79226 1.052525          ?        ? 
1 1 1   21    1   10 f 14.16419 2.533038   28.66699   354.3   2.074978 0.6916593          ?        ? 
1 1 1   21    1   11 o 44.23173 0.9858219   53.74990   109.6   19.57697 0.8720922          ?        ? 
1 1 1   21    1   12 o 16.25555 1.387472   17.29950   212.8   2.646349 0.4510822          ?        ? 
1 1 1   21    1   13 o 60.09478 1.626339   75.69788   333.0   36.20686 1.954689          ?        ? 
1 1 1   21    1   14 o 32.63426 2.534097   40.19982   168.5   10.73576 1.653968          ?        ? 
1 1 1   21    1   15 o 26.14995 1.149988   30.33201   207.6   6.856449 0.6014429          ?        ? 
1 1 1   21    1   16 o 27.08894 1.221139   15.52051   261.3   7.367675 0.6615872          ?        ? 
1 1 1   21    1   17 o 29.01813 1.399036   37.42812   132.1   8.480345 0.8119479          ?        ? 
1 1 1   21    1   18 o 23.76024 1.835193   30.29948   314.0   5.743780 0.8720922          ?        ? 
1 1 1   21    1   19 o 18.27911 2.632263   21.01873    90.2   3.488369 0.9623086          ?        ? 
1 1 1   21    1   20 o 27.11062 1.275624   25.04978    68.8   7.457891 0.6916593          ?        ? 
1 1 1   21    1   21 o 19.26324 1.873338   23.11682   177.9   3.879307 0.7217315          ?        ? 
1 1 1   21    2    0 o 6.129941 3.903861   33.14610   360.0  0.1503607 1.022453  0.1503607 1.022453 
1 1 1   21    2    1 o 100.1795 0.9305663   100.9332   353.5   100.3808 1.864473          ?        ? 
1 1 1   21    2    2 o 58.13335 0.8535383   87.90308    85.0   33.80109 0.9923807          ?        ? 
1 1 1   21    2    3 o 20.51237 1.539351   12.25266    33.9   4.210100 0.6315150          ?        ? 
1 1 1   21    2    4 o 104.1217 0.9386562   126.6431   113.1   108.4402 1.954689          ?        ? 
1 1 1   21    2    5 o 92.84104 0.8907526   114.4392   221.1   86.21684 1.653968          ?        ? 
1 1 1   21    2    6 o 61.40223 0.7836105   88.75127   198.9   37.71047 0.9623086          ?        ? 
1 1 1   21    2    7 o 46.78418 0.7392023   56.32137   197.2   21.89252 0.6916593          ?        ? 
1 1 1   21    2    8 o 10.62029 2.198026   47.70766   330.3   1.172814 0.4510822          ?        ? 
1 1 1   21    2    9 o 32.15179 1.169147   66.76424   317.2   10.34482 0.7518036          ?        ? 
1 1 1   21    2   10 o 23.56595 1.786518   52.90921   244.7   5.563347 0.8420200          ?        ? 
1 1 1   21    2   11 o 83.53963 1.223914   123.4405   257.0   69.85759 2.044906          ?        ? 
1 1 1   21    2   12 o 97.50961 1.310708   114.2483   221.5   95.20841 2.556132          ?        ? 
1 1 1   21    2   13 o 32.64887 1.243455   38.42980   147.5   10.67561 0.8119479          ?        ? 
1 1 1   21    2   14 o 26.99058 1.559840   38.96146   208.9   7.307531 0.8420200          ?        ? 
1 1 1   21    2   15 o 22.73991 1.719171   26.47310   327.9   5.202481 0.7818757          ?        ? 
1 1 1   21    2   16 o 58.53515 1.078865   79.58881    41.8   34.37246 1.263030          ?        ? 
1 1 1   21    2   17 o 6.343712 2.889498   17.97027   217.4 -0.4811543 0.8119479          ?        ? 
1 1 1   21    2   18 o 10.35244 3.520654   19.59655    50.5   1.082597 0.8720922          ?        ? 
1 1 1   21    2   19 o 12.90736 3.669865   18.39950   353.2   1.864473 0.9923807          ?        ? 
1 1 1   21    2   20 o 29.74194 1.819984   30.31398   171.0   9.111859 1.082597          ?        ? 
1 1 1   21    2   21 o 16.75614 2.153633   24.24706   263.6   2.977142 0.7217315          ?        ? 
1 1 1   21    3    0 o 19.10001 2.657529   22.87284     0.0   3.759018 0.9923807   3.759018 0.9923807 
1 1 1   21    3    1 o 28.17143 1.174217   47.48993    42.2   7.939046 0.6615872          ?        ? 
1 1 1   21    3    2 o 15.79070 1.999642   29.56145   205.2   2.495988 0.6315150          ?        ? 
1 1 1   21    3    3 o 105.6418 0.9536155   134.5998   146.0   111.6278 2.014834          ?        ? 
1 1 1   21    3    4 o 124.7523 1.072694   161.6050    63.6   155.6835 2.676421          ?        ? 
1 1 1   21    3    5 o 133.9751 1.077412   130.0275   135.9   179.5608 2.886926          ?        ? 
1 1 1   21    3    6 o 66.25302 0.8170171   45.97057   171.9   43.90533 1.082597          ?        ? 
1 1 1   21    3    7 o 26.00421 1.214255   78.92882    87.1   6.766232 0.6315150          ?        ? 
1 1 1   21    3    8 o 36.48667 1.195083   90.87027    46.1   13.32196 0.8720922          ?        ? 
1 1 1   21    3    9 o 47.41365 1.046514   54.75140   346.3   22.49397 0.9923807          ?        ? 
1 1 1   21    3   10 o 66.73782 1.058913   97.96787    12.5   44.56692 1.413391          ?        ? 
1 1 1   21    3   11 o 49.78272 1.268543   55.15525    80.8   24.80952 1.263030          ?        ? 
1 1 1   21    3   12 o 9.342097 3.829299   4.374686    22.4  0.3007214 1.142741          ?        ? 
1 1 1   21    3   13 o 68.44859 1.142282   78.47216   289.4   46.91254 1.563751          ?        ? 
1 1 1   21    3   14 o 56.46148 1.171750   74.05626   261.4   31.93662 1.323174          ?        ? 
1 1 1   21    3   15 o 33.95417 1.417070   48.89286    79.8   11.57778 0.9623086          ?        ? 
1 1 1   21    3   16 o 13.29873 3.469035   28.52021    54.4   1.894545 0.9322364          ?        ? 
1 1 1   21    3   17 o 18.63857 2.420154   31.97430   111.5   3.548513 0.9021643          ?        ? 
1 1 1   21    3   18 o 15.71153 2.882960   13.22862   158.3   2.646349 0.8720922          ?        ? 
1 1 1   21    3   19 o 9.404346 3.618750   7.052776   236.0  0.7217315 0.9623086          ?        ? 
1 1 1   21    3   20 o 8.438781 3.553155   6.050383    57.2  0.3007214 1.022453          ?        ? 
1 1 1   21    3   21 o 22.17333 2.509027   24.90501   137.9   5.322770 1.112669          ?        ? 
1 1 1   21    4    0 f 26.16740 1.798501   63.49363     0.0   6.946666 0.9322364   6.946666 0.9322364 
1 1 1   21    4    1 o 103.8761 0.9843005   100.6133   236.8   107.9289 2.044906          ?        ? 
1 1 1   21    4    2 o 121.2979 1.053659   153.7352   349.3   147.1731 2.556132          ?        ? 
1 1 1   21    4    3 o 40.59010 0.9631360   70.48991   237.0   16.47953 0.7818757          ?        ? 
1 1 1   21    4    4 o 98.93813 0.9574393   96.58896   278.8   97.91490 1.894545          ?        ? 
1 1 1   21    4    5 o 18.50412 1.950191   19.55789    67.7   3.428224 0.7217315          ?        ? 
1 1 1   21    4    6 o 98.82568 1.019388   122.0319   305.6   97.70440 2.014834          ?        ? 
1 1 1   21    4    7 o 43.34629 0.9018948   48.31953   270.5   18.79509 0.7818757          ?        ? 
1 1 1   21    4    8 o 25.58855 1.586546   37.16693   220.2   6.555727 0.8119479          ?        ? 
1 1 1   21    4    9 o 52.43978 1.032229   82.48174     8.3   27.51601 1.082597          ?        ? 
1 1 1   21    4   10 o 49.39787 1.126232   48.74570   315.5   24.41858 1.112669          ?        ? 
1 1 1   21    4   11 o 56.50476 1.357124   97.20979   336.3   31.96669 1.533679          ?        ? 
1 1 1   21    4   12 o 79.62565 1.246308   90.53217   181.7   63.48230 1.984761          ?        ? 
1 1 1   21    4   13 o 26.16876 2.355782   24.99968   217.9   6.886521 1.232958          ?        ? 
1 1 1   21    4   14 o 18.13029 3.611265   36.80337     8.2   3.458297 1.263030          ?        ? 
1 1 1   21    4   15 o 9.505756 3.543064   15.21623   223.4  0.7217315 0.9021643          ?        ? 
1 1 1   21    4   16 o 11.54690 3.755612   4.491493   289.7   1.353247 0.9923807          ?        ? 
1 1 1   21    4   17 o 18.71828 2.409848   27.15791    63.3   3.578585 0.9021643          ?        ? 
1 1 1   21    4   18 f 36.57854 1.479826   42.12854    60.2   13.53246 1.082597          ?        ? 
1 1 1   21    4   19 o 9.065318 3.688607   13.63172   235.6  0.4811543 1.052525          ?        ? 
1 1 1   21    4   20 o 18.21876 2.723513   18.82215   120.0   3.548513 0.9923807          ?        ? 
1 1 1   21    5    0 o 194.3708 2.050491   242.7757   180.0   378.1272 7.969118   378.1272 7.969118 
1 1 1   21    5    1 o 145.3940 1.168601   195.6204   212.1   211.4673 3.398152          ?        ? 
1 1 1   21    5    2 o 25.94827 1.332766   37.00958    95.8   6.736160 0.6916593          ?        ? 
1 1 1   21    5    3 o 161.5416 1.349640   233.9666     1.6   261.0864 4.360461          ?        ? 
1 1 1   21    5    4 o 119.8698 1.116387   138.7179   342.2   143.7449 2.676421          ?        ? 
1 1 1   21    5    5 o 31.10999 1.256632   28.34874    26.2   9.683230 0.7818757          ?        ? 
1 1 1   21    5    6 o 79.28214 0.9672289   105.5742     3.4   62.88086 1.533679          ?        ? 
1 1 1   21    5    7 o 168.1353 1.502398   193.3366    83.3   282.9488 5.052120          ?        ? 
1 1 1   21    5    8 o 12.14771 3.269426   6.483428    61.7   1.533679 0.8119479          ?        ? 
1 1 1   21    5    9 o 62.40889 1.035992   85.46627   121.3   38.97350 1.293102          ?        ? 
1 1 1   21    5   10 o 71.09750 1.078575   104.7072   144.4   50.58134 1.533679          ?        ? 
1 1 1   21    5   11 o 44.06570 1.740219   54.05506   250.7   19.45668 1.533679          ?        ? 
1 1 1   21    5   12 o 37.66403 1.796471   48.95670    34.0   14.22412 1.353247          ?        ? 
1 1 1   21    5   13 o 94.68554 1.222761   127.9030   231.9   89.79543 2.315555          ?        ? 
1 1 1   21    5   14 f 29.72757 2.225501   29.19255   148.9   8.901355 1.323174          ?        ? 
1 1 1   21    5   15 o 32.29335 2.048680   41.15073   233.8   10.52525 1.323174          ?        ? 
1 1 1   21    5   16 o 30.34602 1.783755   38.97425   322.0   9.292293 1.082597          ?        ? 
1 1 1   21    5   17 o 40.49610 1.522317   52.63868   332.2   16.53968 1.232958          ?        ? 
1 1 1   21    5   18 o 20.54965 2.487763   10.14221   233.2   4.360461 1.022453          ?        ? 
1 1 1   21    5   19 f 30.56842 1.869154   36.42160   168.6   9.562942 1.142741          ?        ? 
1 1 1   21    5   20 o 19.96178 3.012973   20.09857   263.9   4.330389 1.202886          ?        ? 
1 1 1   21    6    0 o 8.464223 4.409823   19.73253   360.0   1.052525 0.9623086   1.052525 0.9623086 
1 1 1   21    6    1 o 37.86808 1.111781   47.70029   322.0   14.34441 0.8420200          ?        ? 
1 1 1   21    6    2 o 49.31727 1.006119   26.33949   177.9   24.32837 0.9923807          ?        ? 
1 1 1   21    6    3 o 36.61606 1.108732   82.02767   195.1   13.41218 0.8119479          ?        ? 
1 1 1   21    6    4 o 95.61439 0.9749960   146.9022   112.5   91.44939 1.864473          ?        ? 
1 1 1   21    6    5 o 46.03658 1.012495   64.47313   149.1   21.20086 0.9322364          ?        ? 
1 1 1   21    6    6 o 50.25067 0.9275862   70.08536   167.2   25.26060 0.9322364          ?        ? 
1 1 1   21    6    7 o 24.75919 1.336043   44.95449   164.2   6.134717 0.6615872          ?        ? 
1 1 1   21    6    8 f 47.44415 1.172610   77.49381   170.5   22.52404 1.112669          ?        ? 
1 1 1   21    6    9 o 46.25447 1.137755   52.96436   118.0   21.41137 1.052525          ?        ? 
1 1 1   21    6   10 o 83.26637 1.047352   98.91647   247.0   69.37643 1.744184          ?        ? 
1 1 1   21    6   11 o 62.63416 1.296334   85.02010    31.8   39.27422 1.623896          ?        ? 
1 1 1   21    6   12 o 23.82339 2.777049   52.43961     1.5   5.713707 1.323174          ?        ? 
1 1 1   21    6   13 o 77.32900 1.419433   91.37965    50.3   59.93378 2.195267          ?        ? 
1 1 1   21    6   14 o 8.102292 3.690014   1.547493   347.3 -0.8119479 1.323174          ?        ? 
1 1 1   21    6   15 o 55.54598 1.326410   77.37803   236.0   30.97431 1.473535          ?        ? 
1 1 1   21    6   16 o 59.35169 1.596033   88.31595   254.2   35.48513 1.894545          ?        ? 
1 1 1   21    6   17 o 14.95333 3.647417   19.81937   146.9   2.435844 1.082597          ?        ? 
1 1 1   21    6   18 o 15.87060 3.670471   23.30976   212.7   2.796710 1.142741          ?        ? 
1 1 1   21    6   19 o 21.38784 2.741776   23.01448   259.8   4.811543 1.172814          ?        ? 
1 1 1   21    6   20 o 29.18247 1.957925   37.76730   334.2   8.841210 1.142741          ?        ? 
1 1 1   21    7    0 o 16.18514 4.200887   2.039044   360.0   3.097431 1.172814   3.097431 1.172814 
1 1 1   21    7    1 o 137.5098 1.377753   208.3754   264.0   189.1839 3.789090          ?        ? 
1 1 1   21    7    2 o 70.89851 1.017978   114.4333    36.3   50.28062 1.443463          ?        ? 
1 1 1   21    7    3 o 185.7085 1.635513   182.3766   200.3   345.1681 6.074574          ?        ? 
1 1 1   21    7    4 o 53.66627 0.9526030   88.58960   100.7   28.80912 1.022453          ?        ? 
1 1 1   21    7    5 o 38.45599 1.133883   83.98181   145.3   14.79550 0.8720922          ?        ? 
1 1 1   21    7    6 o 99.67183 1.025819   136.8423   162.1   99.38844 2.044906          ?        ? 
1 1 1   21    7    7 o 177.9246 1.521146   235.9155   234.3   316.9003 5.412986          ?        ? 
1 1 1   21    7    8 o 41.74857 1.224537   72.32645   322.1   17.44184 1.022453          ?        ? 
1 1 1   21    7    9 o 19.58909 2.302722   17.08443    80.6   3.849235 0.9021643          ?        ? 
1 1 1   21    7   10 o 20.10981 2.542175   44.12379   238.7   4.059740 1.022453          ?        ? 
1 1 1   21    7   11 o 68.52203 1.250775   78.44173   276.9   47.00276 1.714112          ?        ? 
1 1 1   21    7   12 o 48.68818 1.544119   60.34741    38.9   23.75699 1.503607          ?        ? 
1 1 1   21    7   13 o 33.27761 1.988085   58.66199    40.4   11.12669 1.323174          ?        ? 
1 1 1   21    7   14 o 80.90110 1.691303   107.1806   142.9   65.73771 2.736565          ?        ? 
1 1 1   21    7   15 f 42.19778 1.710354   52.48151   184.0   17.92300 1.443463          ?        ? 
1 1 1   21    7   16 o 50.69413 1.720302   69.91888     9.5   25.92219 1.744184          ?        ? 
1 1 1   21    7   17 o 30.20313 1.991327   48.84348    79.2   9.262220 1.202886          ?        ? 
1 1 1   21    7   18 o 15.07650 3.870213   24.44002   153.8   2.556132 1.172814          ?        ? 
1 1 1   21    7   19 o 12.35983 3.849312   10.87907   135.9   1.714112 1.052525          ?        ? 
1 1 1   21    7   20 o 7.605624 3.454545   10.79826   343.1 -0.3608657 1.142741          ?        ? 
1 1 1   21    8    0 o 271.8880 2.887519   376.0503   180.0   740.3461 15.69766   740.3461 15.69766 
1 1 1   21    8    1 o 110.9070 1.206606   166.1251   212.7   123.0552 2.676421          ?        ? 
1 1 1   21    8    2 o 87.32945 1.101929   141.6720   266.9   76.29303 1.924617          ?        ? 
1 1 1   21    8    3 o 106.4107 1.158679   161.4884   331.4   113.2818 2.465916          ?        ? 
1 1 1   21    8    4 o 201.1618 1.704213   276.9564   342.9   405.0417 6.856449          ?        ? 
1 1 1   21    8    5 o 46.09814 1.108996   67.53706    97.2   21.26101 1.022453          ?        ? 
1 1 1   21    8    6 o 55.61924 0.8650861   96.18797     0.3   30.94424 0.9623086          ?        ? 
1 1 1   21    8    7 o 38.18066 1.023916   71.88274   117.7   14.58499 0.7818757          ?        ? 
1 1 1   21    8    8 o 18.40386 2.532720   13.78591   243.7   3.398152 0.9322364          ?        ? 
1 1 1   21    8    9 o 79.73740 1.206847   108.1194    76.9   63.63266 1.924617          ?        ? 
1 1 1   21    8   10 o 49.84407 1.266981   58.17590   146.4   24.86966 1.263030          ?        ? 
1 1 1   21    8   11 o 73.53988 1.124538   87.10505   190.5   54.12986 1.653968          ?        ? 
1 1 1   21    8   12 o 19.89951 3.249081   35.22185   158.1   3.999595 1.293102          ?        ? 
1 1 1   21    8   13 o 51.83036 1.566549   65.10649   149.3   26.94464 1.623896          ?        ? 
1 1 1   21    8   14 o 60.84971 1.408480   72.70560    55.4   37.13910 1.714112          ?        ? 
1 1 1   21    8   15 o 44.97247 1.705131   56.76624    45.4   20.35884 1.533679          ?        ? 
1 1 1   21    8   16 o 12.45453 4.417654   11.54177    91.5   1.473535 1.383319          ?        ? 
1 1 1   21    8   17 o 32.43605 2.364159   41.93204    40.2   10.76583 1.533679          ?        ? 
1 1 1   21    8   18 o 46.28882 1.559192   64.06570    42.6   21.74216 1.443463          ?        ? 
1 1 1   21    8   19 o 18.37436 3.401189   19.37521   293.0   3.759018 1.202886          ?        ? 
1 1 1   21    8   20 o 11.86040 4.128000   15.26295   147.1   1.653968 1.202886          ?        ? 
1 1 1   21    9    0 o 6.459294 4.181325   25.33418   360.0       0.03 1.232958       0.03 1.232958 
1 1 1   21    9    1 o 16.15867 2.512422   51.40750   349.8   2.616277 0.8119479          ?        ? 
1 1 1   21    9    2 o 65.42869 0.9881769   89.89887   229.9   42.82273 1.293102          ?        ? 
1 1 1   21    9    3 o 34.75919 1.340993   32.51394   359.6   12.08900 0.9322364          ?        ? 
1 1 1   21    9    4 o 109.2663 1.142159   167.8969   107.1   119.4466 2.495988          ?        ? 
1 1 1   21    9    5 o 62.60752 1.008689   89.99599   170.4   39.21407 1.263030          ?        ? 
1 1 1   21    9    6 o 71.27811 0.8859873   107.6016   284.8   50.82193 1.263030          ?        ? 
1 1 1   21    9    7 o 62.61113 0.8165104   100.8097   212.4   39.21407 1.022453          ?        ? 
1 1 1   21    9    8 o 91.93582 1.210267   115.4874   294.0   84.59294 2.225339          ?        ? 
1 1 1   21    9    9 f 57.09495 1.290425   44.33892   213.0   32.62828 1.473535          ?        ? 
1 1 1   21    9   10 o 50.32476 1.225001   70.47296   125.6   25.35082 1.232958          ?        ? 
1 1 1   21    9   11 o 34.38387 1.705471   48.12843   177.5   11.84843 1.172814          ?        ? 
1 1 1   21    9   12 o 69.02416 1.328811   85.14421   181.0   47.72449 1.834401          ?        ? 
1 1 1   21    9   13 o 46.93577 1.665842   53.04482   265.4   22.10303 1.563751          ?        ? 
1 1 1   21    9   14 o 47.42301 1.617020   49.93201   306.0   22.58418 1.533679          ?        ? 
1 1 1   21    9   15 o 34.80891 2.073410   40.99655   101.5   12.23936 1.443463          ?        ? 
1 1 1   21    9   16 o 32.23713 2.005610   49.43987   226.9   10.52525 1.293102          ?        ? 
1 1 1   21    9   17 o 32.07126 2.391049   44.08891   281.1   10.55532 1.533679          ?        ? 
1 1 1   21    9   18 o 26.36780 2.851218   36.29350   340.1   7.307531 1.503607          ?        ? 
1 1 1   21    9   19 o 17.54638 3.713111   26.99723    50.1   3.518441 1.263030          ?        ? 
1 1 1   21    9   20 o 6.620617 3.183759   10.33703    79.9  -1.413391 1.232958          ?        ? 
1 1 1   21   10    0 o 145.0245 1.949965   241.6815   180.0   210.5652 5.653563   210.5652 5.653563 
1 1 1   21   10    1 o 105.4164 1.183871   164.3301   230.2   111.1767 2.495988          ?        ? 
1 1 1   21   10    2 o 16.88768 2.314929   38.66285   173.0   2.856854 0.7818757          ?        ? 
1 1 1   21   10    3 o 108.1877 1.181342   180.4519   278.6   117.1009 2.556132          ?        ? 
1 1 1   21   10    4 o 83.10904 1.103611   116.3838   269.9   69.10579 1.834401          ?        ? 
1 1 1   21   10    5 o 59.63218 1.033803   45.66975   188.2   35.57535 1.232958          ?        ? 
1 1 1   21   10    6 o 136.7667 1.176353   179.7624   126.5   187.1690 3.217719          ?        ? 
1 1 1   21   10    7 o 48.01832 0.8454565   68.42127   210.0   23.06533 0.8119479          ?        ? 
1 1 1   21   10    8 o 27.71265 2.007512   59.10525   294.0   7.698469 1.112669          ?        ? 
1 1 1   21   10    9 o 12.06456 3.665361   20.63004    61.8   1.473535 0.9623086          ?        ? 
1 1 1   21   10   10 o 73.80182 1.222415   93.79074   116.5   54.52080 1.804329          ?        ? 
1 1 1   21   10   11 o 68.75797 1.224614   59.11769    76.6   47.33355 1.684040          ?        ? 
1 1 1   21   10   12 o 61.53515 1.514966   80.45705    36.0   37.95105 1.864473          ?        ? 
1 1 1   21   10   13 o 41.21461 1.751155   51.86794   328.3   17.05091 1.443463          ?        ? 
1 1 1   21   10   14 o 39.49778 1.827271   66.24530   194.7   15.69766 1.443463          ?        ? 
1 1 1   21   10   15 o 47.57443 1.517058   64.35399   207.2   22.76461 1.443463          ?        ? 
1 1 1   21   10   16 o 44.89940 1.707906   58.66053   322.1   20.35884 1.533679          ?        ? 
1 1 1   21   10   17 o 39.98658 1.880140   47.78856   297.3   16.26903 1.503607          ?        ? 
1 1 1   21   10   18 o 31.30700 2.113225   41.60392   266.0   10.07417 1.323174          ?        ? 
1 1 1   21   10   19 o 15.29696 3.915215   23.95433   172.8   2.736565 1.202886          ?        ? 
1 1 1   21   10   20 o 21.64598 3.125861   32.38902   156.1   5.232553 1.353247          ?        ? 
1 1 1   21   11    0 o 220.4739 2.578708   226.7419   180.0   486.8079 11.36727   486.8079 11.36727 
1 1 1   21   11    1 o 32.43106 1.483622   63.59444   136.3   10.52525 0.9623086          ?        ? 
1 1 1   21   11    2 o 104.4819 1.237632   165.7609   251.3   109.2220 2.586205          ?        ? 
1 1 1   21   11    3 o 77.64957 1.123113   104.3684   252.9   60.32472 1.744184          ?        ? 
1 1 1   21   11    4 o 112.8004 1.266332   132.9231    53.2   127.3255 2.856854          ?        ? 
1 1 1   21   11    5 o 136.8197 1.274805   205.6944    10.5   187.3194 3.488369          ?        ? 
1 1 1   21   11    6 o 86.75684 0.9532205   107.4277   329.8   75.30065 1.653968          ?        ? 
1 1 1   21   11    7 o 58.38592 0.8498459   67.74445   325.5   34.10181 0.9923807          ?        ? 
1 1 1   21   11    8 o 70.90038 1.208817   95.19584   199.6   50.31070 1.714112          ?        ? 
1 1 1   21   11    9 o 36.83864 1.632642   67.02922   250.9   13.59261 1.202886          ?        ? 
1 1 1   21   11   10 o 20.31176 2.961057   33.49983   275.5   4.149956 1.202886          ?        ? 
1 1 1   21   11   11 o 83.17561 1.319658   96.40157   265.1   69.28622 2.195267          ?        ? 
1 1 1   21   11   12 o 41.24588 1.458189   54.84258   303.6   17.05091 1.202886          ?        ? 
1 1 1   21   11   13 o 45.39451 1.689278   53.69468   134.0   20.68964 1.533679          ?        ? 
1 1 1   21   11   14 o 22.40247 2.953188   35.65627   169.2   5.112265 1.323174          ?        ? 
1 1 1   21   11   15 o 24.04581 3.001486   13.30339     0.9   5.924213 1.443463          ?        ? 
1 1 1   21   11   16 o 20.81110 3.395761   32.59921   208.0   4.510822 1.413391          ?        ? 
1 1 1   21   11   17 o 23.74373 2.976345   25.89601   166.0   5.894140 1.413391          ?        ? 
1 1 1   21   11   18 f 36.57643 2.096541   43.72957   139.0   13.74297 1.533679          ?        ? 
1 1 1   21   11   19 o 7.007458 3.361408   16.57762    60.0  -1.563751 1.353247          ?        ? 
1 1 1   21   11   20 o 11.14330 4.102682   13.48564   318.0   1.413391 1.202886          ?        ? 
1 1 1   21   12    0 o 184.3415 2.284646   224.6214     0.0   340.2964 8.420200   340.2964 8.420200 
1 1 1   21   12    1 o 29.72220 1.467072   53.68704   156.0   8.841210 0.8720922          ?        ? 
1 1 1   21   12    2 o 119.5825 1.194511   182.9002   127.3   143.0833 2.856854          ?        ? 
1 1 1   21   12    3 o 197.6427 1.719341   230.7361    32.8   391.1183 6.796305          ?        ? 
1 1 1   21   12    4 o 185.2133 1.469402   258.5987   308.5   343.3336 5.443058          ?        ? 
1 1 1   21   12    5 o 75.99050 0.9299787   87.51201   201.4   57.76859 1.413391          ?        ? 
1 1 1   21   12    6 o 69.00402 0.9151858   82.45659   271.2   47.63427 1.263030          ?        ? 
1 1 1   21   12    7 o 9.255468 2.736228   19.07451   106.6  0.8720922 0.5412986          ?        ? 
1 1 1   21   12    8 o 65.63649 1.328670   113.7961    41.9   43.12346 1.744184          ?        ? 
1 1 1   21   12    9 o 28.02744 2.145907   29.99217   116.0   7.878902 1.202886          ?        ? 
1 1 1   21   12   10 o 67.54648 1.291100   88.00131    72.7   45.67958 1.744184          ?        ? 
1 1 1   21   12   11 o 50.62893 1.425532   62.16994    36.3   25.68161 1.443463          ?        ? 
1 1 1   21   12   12 o 25.88962 2.032716   42.49717    62.8   6.736160 1.052525          ?        ? 
1 1 1   21   12   13 o 10.67738 4.211864   19.24603    22.0  0.6916593 1.323174          ?        ? 
1 1 1   21   12   14 o 70.65718 1.361940   90.01092   277.5   50.13026 1.924617          ?        ? 
1 1 1   21   12   15 o 7.007768 3.343261   6.581177     3.0  -1.593824 1.293102          ?        ? 
1 1 1   21   12   16 o 33.17058 2.130489   41.10537    61.5   11.18684 1.413391          ?        ? 
1 1 1   21   12   17 o 37.69997 1.954292   43.38519    91.4   14.49477 1.473535          ?        ? 
1 1 1   21   12   18 f 8.083375 3.698081   7.435603   335.5 -0.6916593 1.353247          ?        ? 
1 1 1   21   12   19 o 8.883291 3.931884   13.72838   340.0      -0.06 1.383319          ?        ? 
1 1 1   21   12   20 o 10.37710 4.226579   9.679344    18.1  0.9923807 1.383319          ?        ? 
1 1 1   21   13    0 o 8.731184 4.957063   3.470819   180.0   1.022453 1.323174   1.022453 1.323174 
1 1 1   21   13    1 f 65.92573 1.094765   123.3446   277.3   43.48432 1.443463          ?        ? 
1 1 1   21   13    2 o 98.45126 1.175991   142.7470   327.8   96.98267 2.315555          ?        ? 
1 1 1   21   13    3 o 124.3600 1.257439   154.5639   253.5   154.7513 3.127503          ?        ? 
1 1 1   21   13    4 f 112.3670 1.124022   113.7792   255.2   126.3331 2.526060          ?        ? 
1 1 1   21   13    5 o 87.65146 0.9949546   106.1005    68.0   76.86440 1.744184          ?        ? 
1 1 1   21   13    6 o 69.56638 0.9294018   108.6032    97.9   48.41615 1.293102          ?        ? 
1 1 1   21   13    7 o 75.09228 0.9010558   138.0877   350.8   56.41534 1.353247          ?        ? 
1 1 1   21   13    8 o 70.06373 0.8155015   105.2281    29.0   49.10781 1.142741          ?        ? 
1 1 1   21   13    9 o 134.8722 1.505032   195.9419   341.8   182.1770 4.059740          ?        ? 
1 1 1   21   13   10 o 95.25075 1.310220   126.8753     1.4   90.84795 2.495988          ?        ? 
1 1 1   21   13   11 o 75.70514 1.310850   105.7926   130.2   57.40772 1.984761          ?        ? 
1 1 1   21   13   12 o 12.52328 4.026490   6.282549   261.4   1.563751 1.142741          ?        ? 
1 1 1   21   13   13 o 23.72873 3.104960   30.76459   169.9   5.713707 1.473535          ?        ? 
1 1 1   21   13   14 o 9.335799 3.990605   14.84040   357.8       0.03 1.323174          ?        ? 
1 1 1   21   13   15 o 55.69603 1.565807   73.13438   319.7   31.24496 1.744184          ?        ? 
1 1 1   21   13   16 o 44.11850 1.772218   52.08937    17.0   19.69725 1.563751          ?        ? 
1 1 1   21   13   17 o 22.99279 2.746578   31.18538   107.4   5.503202 1.263030          ?        ? 
1 1 1   21   13   18 o 9.474632 4.066094   6.388797   328.8  0.2105050 1.383319          ?        ? 
1 1 1   21   13   19 o 17.13875 4.231049   15.45652    61.8   3.548513 1.443463          ?        ? 
1 1 1   21   14    0 f 84.64679 1.510957   78.75322   180.0   71.75214 2.556132   71.75214 2.556132 
1 1 1   21   14    1 o 85.76173 1.104540   106.3557    26.6   73.58654 1.894545          ?        ? 
1 1 1   21   14    2 o 68.36570 1.121673   80.12196   294.0   46.76218 1.533679          ?        ? 
1 1 1   21   14    3 o 101.9500 1.061890   118.8143   196.2   103.9895 2.165194          ?        ? 
1 1 1   21   14    4 o 36.52781 1.193737   36.53274   279.3   13.35203 0.8720922          ?        ? 
1 1 1   21   14    5 o 41.46197 1.124207   57.09636   227.5   17.20127 0.9322364          ?        ? 
1 1 1   21   14    6 o 97.92751 1.044092   145.4464   110.8   95.96021 2.044906          ?        ? 
1 1 1   21   14    7 o 81.88842 0.9548062   115.0005    38.8   67.09096 1.563751          ?        ? 
1 1 1   21   14    8 o 32.61497 1.106442   54.30820   107.6   10.64554 0.7217315          ?        ? 
1 1 1   21   14    9 o 53.63709 1.429682   52.85433   343.0   28.80912 1.533679          ?        ? 
1 1 1   21   14   10 o 28.90409 2.236885   51.09197    59.0   8.390128 1.293102          ?        ? 
1 1 1   21   14   11 o 17.50161 3.642810   20.92385   176.2   3.217719 1.232958          ?        ? 
1 1 1   21   14   12 o 31.43033 1.913575   30.85342   237.1   9.923808 1.202886          ?        ? 
1 1 1   21   14   13 o 35.74162 2.061371   57.06353   344.5   12.87088 1.473535          ?        ? 
1 1 1   21   14   14 o 7.474311 3.553608   22.77714    39.5  -1.714112 1.443463          ?        ? 
1 1 1   21   14   15 o 16.89786 4.196052   22.41289   320.0   3.127503 1.413391          ?        ? 
1 1 1   21   14   16 o 24.13965 2.927530   19.67392   175.5   6.044501 1.413391          ?        ? 
1 1 1   21   14   17 o 14.19774 4.573022   19.27773   112.3   2.285483 1.473535          ?        ? 
1 1 1   21   14   18 o 8.685661 3.881229   10.73004   276.6 -0.2706493 1.383319          ?        ? 
1 1 1   21   14   19 o 12.20704 4.494268   18.49199   140.6   1.714112 1.443463          ?        ? 
1 1 1   21   15    0 o 8.582341 4.782461   67.06202   360.0   1.022453 1.202886   1.022453 1.202886 
1 1 1   21   15    1 o 48.94210 1.167442   55.63301   125.5   23.96750 1.142741          ?        ? 
1 1 1   21   15    2 o 73.22430 1.108850   104.5558    77.8   53.64870 1.623896          ?        ? 
1 1 1   21   15    3 o 27.12983 1.440989   24.01546   300.4   7.367675 0.7818757          ?        ? 
1 1 1   21   15    4 o 29.41504 1.431275   59.17283   178.5   8.660777 0.8420200          ?        ? 
1 1 1   21   15    5 o 83.73672 1.005557   141.0164   358.8   70.15832 1.684040          ?        ? 
1 1 1   21   15    6 o 49.03334 1.042610   61.15348   172.1   24.05772 1.022453          ?        ? 
1 1 1   21   15    7 f 101.7516 1.049184   95.91555   141.6   103.5985 2.135122          ?        ? 
1 1 1   21   15    8 o 46.74387 0.9328413   54.98198   131.7   21.86245 0.8720922          ?        ? 
1 1 1   21   15    9 o 59.42174 0.9868558   45.86375   167.9   35.33477 1.172814          ?        ? 
1 1 1   21   15   10 o 68.67242 1.379408   85.89285   209.8   47.24334 1.894545          ?        ? 
1 1 1   21   15   11 o 100.5871 1.375245   127.5031   231.1   101.4033 2.766637          ?        ? 
1 1 1   21   15   12 o 16.60051 3.632246   11.79977   145.9   2.916998 1.172814          ?        ? 
1 1 1   21   15   13 o 39.78225 1.549633   31.81426   329.1   15.90816 1.232958          ?        ? 
1 1 1   21   15   14 o 34.11263 2.203887   39.26639    16.5   11.78828 1.503607          ?        ? 
1 1 1   21   15   15 o 10.82730 4.263110   16.17236    23.0  0.8119479 1.353247          ?        ? 
1 1 1   21   15   16 o 28.22540 2.770114   19.28452   333.8   8.269840 1.563751          ?        ? 
1 1 1   21   15   17 o 9.764421 4.193732   12.73671   221.5  0.2105050 1.473535          ?        ? 
1 1 1   21   15   18 o 8.978425 3.989802   6.547832   263.7 -0.1503607 1.443463          ?        ? 
1 1 1   21   15   19 o 17.43535 4.326907   26.47116    17.4   3.819162 1.503607          ?        ? 
1 1 1   21   16    0 o 7.709035 4.832160   31.12228   180.0  0.3909379 1.503607  0.3909379 1.503607 
1 1 1   21   16    1 o 58.24970 1.135778   69.23668   318.0   33.95145 1.323174          ?        ? 
1 1 1   21   16    2 o 68.43294 0.9887391   80.09463    16.4   46.85240 1.353247          ?        ? 
1 1 1   21   16    3 o 86.07656 1.013159   99.07553   180.0   74.12784 1.744184          ?        ? 
1 1 1   21   16    4 o 83.61221 0.9890708   129.4896   136.8   69.94781 1.653968          ?        ? 
1 1 1   21   16    5 o 114.7920 1.100277   143.0962    90.2   131.8663 2.526060          ?        ? 
1 1 1   21   16    6 o 60.10636 0.9756154   84.85894   203.7   36.14672 1.172814          ?        ? 
1 1 1   21   16    7 f 37.21717 1.171626   92.67246   152.3   13.86326 0.8720922          ?        ? 
1 1 1   21   16    8 f 7.767404 2.998085   25.84891   155.2  0.3909379 0.6615872          ?        ? 
1 1 1   21   16    9 o 79.49558 0.9457175   101.2987    98.8   63.24172 1.503607          ?        ? 
1 1 1   21   16   10 o 103.9384 1.374302   128.1008   102.0   108.2296 2.856854          ?        ? 
1 1 1   21   16   11 o 24.97830 2.468058   41.36229   278.8   6.285078 1.232958          ?        ? 
1 1 1   21   16   12 o 7.426377 3.416378   12.92078   274.5 -0.8720922 1.172814          ?        ? 
1 1 1   21   16   13 o 8.892474 3.723600   13.87528    60.7  0.1804329 1.112669          ?        ? 
1 1 1   21   16   14 o 11.76327 4.386744   15.54664    29.9   1.172814 1.383319          ?        ? 
1 1 1   21   16   15 o 32.09441 2.436175   41.33801   299.1   10.52525 1.563751          ?        ? 
1 1 1   21   16   16 o 14.37914 4.157049   14.73465   141.5   2.315555 1.263030          ?        ? 
1 1 1   21   16   17 o 14.65015 4.440376   23.76772   310.6   2.465916 1.413391          ?        ? 
1 1 1   21   16   18 o 21.70561 3.463637   22.17464   250.5   5.202481 1.503607          ?        ? 
1 1 1   21   16   19 o 14.76472 4.656279   16.12042   232.0   2.856854 1.533679          ?        ? 
1 1 1   21   17    0 o 117.3953 1.717104   124.3449   180.0   138.0011 4.029667   138.0011 4.029667 
1 1 1   21   17    1 o 81.49953 1.088507   105.5283     3.5   66.45944 1.774257          ?        ? 
1 1 1   21   17    2 o 86.94254 1.037656   107.8050   141.1   75.63145 1.804329          ?        ? 
1 1 1   21   17    3 o 65.14255 1.038681   89.48798   353.6   42.46187 1.353247          ?        ? 
1 1 1   21   17    4 o 53.96347 1.058810   65.46812   271.7   29.13991 1.142741          ?        ? 
1 1 1   21   17    5 o 92.03005 1.012970   116.8501   194.6   84.74330 1.864473          ?        ? 
1 1 1   21   17    6 o 130.8442 1.206616   145.4259   164.2   171.3511 3.157575          ?        ? 
1 1 1   21   17    7 o 53.42939 1.069394   82.44461   223.0   28.56854 1.142741          ?        ? 
1 1 1   21   17    8 o 29.35739 1.382868   35.61176   182.8   8.630706 0.8119479          ?        ? 
1 1 1   21   17    9 o 20.48930 1.761240   13.35730   317.8   4.210100 0.7217315          ?        ? 
1 1 1   21   17   10 o 22.98457 1.308362   7.122119   106.8   5.292697 0.6014429          ?        ? 
1 1 1   21   17   11 o 22.01744 2.936542   18.85208    55.8   4.901759 1.293102          ?        ? 
1 1 1   21   17   12 o 30.13045 1.996130   39.77882   351.4   9.141932 1.202886          ?        ? 
1 1 1   21   17   13 o 22.48003 2.742340   52.64155   261.0   5.142337 1.232958          ?        ? 
1 1 1   21   17   14 o 10.72025 4.309075   7.953658    84.9  0.6615872 1.413391          ?        ? 
1 1 1   21   17   15 o 10.57824 4.166584   13.80728   337.6  0.7818757 1.293102          ?        ? 
1 1 1   21   17   16 o 7.845054 3.681239   12.83177     7.5  -1.293102 1.473535          ?        ? 
1 1 1   21   17   17 o 29.58889 2.591647   28.26732    45.4   9.141932 1.533679          ?        ? 
1 1 1   21   17   18 o 18.85999 4.100778   26.96388    56.9   4.210100 1.503607          ?        ? 
1 1 1   21   17   19 o 8.808986 3.968474   6.612494   243.6      -0.09 1.473535          ?        ? 
1 1 1   21   18    0 o 8.234509 4.928056  0.8165492   180.0  0.7518036 1.413391  0.7518036 1.413391 
1 1 1   21   18    1 o 106.7768 1.098379   111.7402   201.7   114.0937 2.345627          ?        ? 
1 1 1   21   18    2 o 29.35586 1.587820   48.69839   279.5   8.630706 0.9322364          ?        ? 
1 1 1   21   18    3 o 82.66981 1.018534   97.83336    61.0   68.38406 1.684040          ?        ? 
1 1 1   21   18    4 o 93.87162 1.041150   123.9038   110.5   88.17153 1.954689          ?        ? 
1 1 1   21   18    5 o 30.95213 1.505932   24.42458   326.8   9.593014 0.9322364          ?        ? 
1 1 1   21   18    6 o 99.35387 1.074504   111.0301   177.5   98.78699 2.135122          ?        ? 
1 1 1   21   18    7 o 88.47812 1.002653   104.8293   159.6   78.33794 1.774257          ?        ? 
1 1 1   21   18    8 o 47.05474 1.086450   69.62803   204.8   22.16317 1.022453          ?        ? 
1 1 1   21   18    9 o 34.26524 1.228680   44.76747   217.3   11.75821 0.8420200          ?        ? 
1 1 1   21   18   10 o 26.60773 1.412754   41.83642   257.9   7.097026 0.7518036          ?        ? 
1 1 1   21   18   11 o 37.72113 1.076251   44.46052   274.3   14.25420 0.8119479          ?        ? 
1 1 1   21   18   12 o 10.47719 3.968453   7.015122    25.6  0.8420200 1.142741          ?        ? 
1 1 1   21   18   13 f 24.60453 2.627773   32.59464   143.2   6.164790 1.293102          ?        ? 
1 1 1   21   18   14 o 9.990042 4.214783   9.147718   310.7  0.2405772 1.443463          ?        ? 
1 1 1   21   18   15 f 29.87860 2.113603   44.12959   151.2   9.111859 1.263030          ?        ? 
1 1 1   21   18   16 o 27.22809 2.871578   31.51093    16.8   7.788685 1.563751          ?        ? 
1 1 1   21   18   17 o 10.89759 4.417886   11.24407   307.9  0.8720922 1.503607          ?        ? 
1 1 1   21   18   18 o 18.32539 4.191626   19.99055    98.5   4.059740 1.503607          ?        ? 
1 1 1   21   19    0 o 11.93427 4.956890   6.841571   180.0   2.014834 1.172814   2.014834 1.172814 
1 1 1   21   19    1 o 10.22152 3.573287   26.80689   145.9  0.9322364 0.9021643          ?        ? 
1 1 1   21   19    2 o 56.51657 1.197212   70.62695   197.8   31.96669 1.353247          ?        ? 
1 1 1   21   19    3 o 83.74601 1.184989   96.93242    36.8   70.18839 1.984761          ?        ? 
1 1 1   21   19    4 o 40.97566 1.431110   65.87247   215.3   16.81033 1.172814          ?        ? 
1 1 1   21   19    5 o 53.98141 1.253438   56.48764    28.1   29.16998 1.353247          ?        ? 
1 1 1   21   19    6 o 80.94529 1.225990   70.88388   339.8   65.58735 1.984761          ?        ? 
1 1 1   21   19    7 o 37.91818 1.546506   45.04330   252.7   14.40456 1.172814          ?        ? 
1 1 1   21   19    8 o 26.80786 2.131356   44.44674   286.7   7.217315 1.142741          ?        ? 
1 1 1   21   19    9 o 48.93658 1.382653   58.35447   287.2   23.99757 1.353247          ?        ? 
1 1 1   21   19   10 o 34.28099 1.579005   40.88406   174.3   11.78828 1.082597          ?        ? 
1 1 1   21   19   11 o 18.75154 2.405574   25.71189    61.9   3.548513 0.9021643          ?        ? 
1 1 1   21   19   12 f 69.03343 0.9583576   78.90570   333.4   47.75457 1.323174          ?        ? 
1 1 1   21   19   13 o 46.89293 1.507040   62.91457   348.2   22.13310 1.413391          ?        ? 
1 1 1   21   19   14 o 14.70334 4.605151   16.33175   292.9   2.345627 1.503607          ?        ? 
1 1 1   21   19   15 o 20.92007 3.162452   24.60073    97.4   4.601038 1.323174          ?        ? 
1 1 1   21   19   16 o 9.447252 4.105330   7.513352   259.3       0.06 1.443463          ?        ? 
1 1 1   21   19   17 o 7.782548 3.629932   5.884409   280.4 -0.9322364 1.383319          ?        ? 
1 1 1   21   19   18 o 8.021364 3.728403   3.286449   227.7 -0.7217315 1.443463          ?        ? 
1 1 1   21   20    0 o 141.9546 2.055847   155.6642    -0.0   201.8743 5.833996   201.8743 5.833996 
1 1 1   21   20    1 f 46.92829 1.281621   49.71155   105.5   22.04288 1.202886          ?        ? 
1 1 1   21   20    2 o 19.57392 2.842224   43.46668   169.1   3.849235 1.112669          ?        ? 
1 1 1   21   20    3 o 33.27958 1.762062   8.590811   233.0   11.09662 1.172814          ?        ? 
1 1 1   21   20    4 o 52.36420 1.407006   49.87939    85.8   27.45587 1.473535          ?        ? 
1 1 1   21   20    5 o 19.95007 2.713267   21.14318   288.4   3.999595 1.082597          ?        ? 
1 1 1   21   20    6 o 66.89865 1.258650   82.95083    69.2   44.80750 1.684040          ?        ? 
1 1 1   21   20    7 o 68.18248 1.234951   83.17353   346.6   46.55168 1.684040          ?        ? 
1 1 1   21   20    8 o 105.4312 1.354842   133.2825   269.9   111.3571 2.856854          ?        ? 
1 1 1   21   20    9 o 17.54594 3.292152   23.64670   217.0   3.217719 1.112669          ?        ? 
1 1 1   21   20   10 o 63.52700 1.207108   58.64141   313.3   40.44703 1.533679          ?        ? 
1 1 1   21   20   11 o 56.06041 1.153311   68.88154   219.7   31.51561 1.293102          ?        ? 
1 1 1   21   20   12 o 44.03651 1.160915   61.40696   274.7   19.45668 1.022453          ?        ? 
1 1 1   21   20   13 o 18.19118 3.599594   18.49017   103.4   3.548513 1.263030          ?        ? 
1 1 1   21   20   14 o 38.73044 2.057585   54.55662   329.9   15.24658 1.593824          ?        ? 
1 1 1   21   20   15 o 21.16488 3.196915   17.44414    12.6   4.721327 1.353247          ?        ? 
1 1 1   21   20   16 o 26.46072 2.613909   25.39053   224.4   7.307531 1.383319          ?        ? 
1 1 1   21   20   17 o 12.34517 4.370327   13.38603    36.0   1.714112 1.353247          ?        ? 
1 1 1   21   20   18 o 11.25220 4.528509   3.673250    62.9   1.293102 1.563751          ?        ? 
1 1 1   21   21    0 o 6.047200 4.202147   17.99795   180.0  -1.232958 1.684040  -1.232958 1.684040 
1 1 1   21   21    1 o 18.95216 2.697457   23.31744   266.5   3.608657 1.022453          ?        ? 
1 1 1   21   21    2 o 29.21942 2.418581   74.49998   296.4   8.570561 1.413391          ?        ? 
1 1 1   21   21    3 o 26.71672 2.026067   52.28619   120.5   7.157170 1.082597          ?        ? 
1 1 1   21   21    4 o 124.2763 1.330879   151.4538    63.6   154.6310 3.307936          ?        ? 
1 1 1   21   21    5 o 35.11578 1.755561   41.23226   206.9   12.35965 1.232958          ?        ? 
1 1 1   21   21    6 o 80.35213 1.272465   117.8777    40.1   64.65511 2.044906          ?        ? 
1 1 1   21   21    7 f 69.40265 1.213239   85.12683   102.9   48.23572 1.684040          ?        ? 
1 1 1   21   21    8 o 35.88417 1.885576   46.85974   115.1   12.93102 1.353247          ?        ? 
1 1 1   21   21    9 o 21.77410 2.555030   42.34480   219.2   4.781471 1.112669          ?        ? 
1 1 1   21   21   10 o 67.78666 1.109073   64.76444   169.2   46.04045 1.503607          ?        ? 
1 1 1   21   21   11 o 26.53034 1.926951   32.73248   225.3   7.097026 1.022453          ?        ? 
1 1 1   21   21   12 o 42.41534 1.276186   53.69167    54.4   18.07336 1.082597          ?        ? 
1 1 1   21   21   13 o 41.22385 1.203649   49.68720   139.7   17.08098 0.9923807          ?        ? 
1 1 1   21   21   14 o 26.96554 2.118892   29.21793   300.8   7.427820 1.142741          ?        ? 
1 1 1   21   21   15 o 7.878510 3.711827   22.28629    47.2  -1.413391 1.533679          ?        ? 
1 1 1   21   21   16 f 11.90817 4.606610   11.72835    69.0   1.323174 1.563751          ?        ? 
1 1 1   21   21   17 o 6.175772 3.074183  0.7296245   301.3  -3.338008 1.503607          ?        ? 
1 1 1   21   21   18 o 7.946478 3.615335   19.09122   201.7 -0.3007214 1.263030          ?        ? 
1 1 1   21   22    0 o 95.91189 1.867137   100.5349   180.0   92.20119 3.578585   92.20119 3.578585 
1 1 1   21   22    1 o 49.89664 1.416319   54.03615   339.4   24.92981 1.413391          ?        ? 
1 1 1   21   22    2 o 16.33427 3.595135   27.27856    98.2   2.796710 1.142741          ?        ? 
1 1 1   21   22    3 o 43.50930 1.831589   37.80098   112.1   18.97552 1.593824          ?        ? 
1 1 1   21   22    4 o 47.00655 1.471410   51.41787   217.6   22.13310 1.383319          ?        ? 
1 1 1   21   22    5 o 64.16338 1.288872   94.62010   143.6   41.22891 1.653968          ?        ? 
1 1 1   21   22    6 o 63.35662 1.305284   70.22706    65.3   40.20646 1.653968          ?        ? 
1 1 1   21   22    7 o 67.01691 1.233993   66.92046    54.9   44.98793 1.653968          ?        ? 
1 1 1   21   22    8 o 84.22079 1.231868   95.54401   120.1   71.06048 2.074978          ?        ? 
1 1 1   21   22    9 o 34.51941 1.698774   38.50330   110.3   11.96871 1.172814          ?        ? 
1 1 1   21   22   10 o 38.94730 1.544248   52.60191    98.1   15.24658 1.202886          ?        ? 
1 1 1   21   22   11 o 6.068314 2.923881   8.118917    44.7  -1.563751 1.052525          ?        ? 
1 1 1   21   22   12 o 23.09597 2.213488   38.87824    31.7   5.412986 1.022453          ?        ? 
1 1 1   21   22   13 o 23.55412 1.915089   37.52541   145.5   5.623491 0.9021643          ?        ? 
1 1 1   21   22   14 f 39.73470 1.210917   41.32862   192.8   15.90816 0.9623086          ?        ? 
1 1 1   21   22   15 o 14.28138 2.729679   13.45868   203.8   2.195267 0.7518036          ?        ? 
1 1 1   21   22   16 o 9.324852 4.099400   12.55855   204.5       0.03 1.473535          ?        ? 
1 1 1   21   22   17 o 11.21920 4.469489   10.19773   155.9   1.263030 1.503607          ?        ? 
1 1 1   21   23    0 o 5.967642 4.151754   2.933812     0.0  -1.323174 1.684040  -1.323174 1.684040 
1 1 1   21   23    1 o 58.81830 1.354871   71.75679   265.3   34.64311 1.593824          ?        ? 
1 1 1   21   23    2 o 59.62764 1.361697   65.48905    14.6   35.60542 1.623896          ?        ? 
1 1 1   21   23    3 o 52.95875 1.334426   53.57521   163.2   28.08738 1.413391          ?        ? 
1 1 1   21   23    4 o 52.07785 1.616849   53.39216   104.3   27.18522 1.684040          ?        ? 
1 1 1   21   23    5 o 33.65830 1.876254   53.72410    59.3   11.36727 1.263030          ?        ? 
1 1 1   21   23    6 o 83.29324 1.263638   102.1059   257.8   69.49673 2.105050          ?        ? 
1 1 1   21   23    7 o 34.13538 1.805982   47.61860   105.5   11.69806 1.232958          ?        ? 
1 1 1   21   23    8 o 31.79152 1.939130   53.80031    92.4   10.16438 1.232958          ?        ? 
1 1 1   21   23    9 o 40.12967 1.611155   46.67363   349.0   16.17881 1.293102          ?        ? 
1 1 1   21   23   10 f 20.03077 2.927531   23.46580   309.3   4.089812 1.172814          ?        ? 
1 1 1   21   23   11 o 14.36674 3.884065   13.58193   334.2   2.225339 1.142741          ?        ? 
1 1 1   21   23   12 o 17.13372 3.190510   20.15018   102.1   3.127503 1.052525          ?        ? 
1 1 1   21   23   13 o 20.55893 2.340367   31.61555   192.2   4.330389 0.9623086          ?        ? 
1 1 1   21   23   14 o 31.97255 1.457870   33.81752   240.8   10.34482 0.9322364          ?        ? 
1 1 1   21   23   15 o 25.35938 1.719467   25.30207   266.9   6.555727 0.8720922          ?        ? 
1 1 1   21   23   16 o 19.85924 2.044258   20.86604   116.9   4.089812 0.8119479          ?        ? 
1 1 1   21   23   17 o 20.18277 4.165111   26.66422   269.7   5.022048 1.623896          ?        ? 
1 1 1   21   24    0 o 73.51677 1.802230   116.6545   180.0   54.22008 2.646349   54.22008 2.646349 
1 1 1   21   24    1 o 62.35131 1.398675   62.63593   214.7   38.94343 1.744184          ?        ? 
1 1 1   21   24    2 o 65.10960 1.339422   92.58965    42.6   42.46187 1.744184          ?        ? 
1 1 1   21   24    3 o 59.36673 1.342354   79.63186   359.7   35.30470 1.593824          ?        ? 
1 1 1   21   24    4 o 34.19238 1.802972   45.63634    80.2   11.72814 1.232958          ?        ? 
1 1 1   21   24    5 o 14.63163 4.498019   22.52663   219.5   2.195267 1.443463          ?        ? 
1 1 1   21   24    6 o 58.05164 1.320961   44.38700   329.5   33.77102 1.533679          ?        ? 
1 1 1   21   24    7 o 36.50316 1.730028   33.96945   343.8   13.38210 1.263030          ?        ? 
1 1 1   21   24    8 o 13.08655 3.934446   17.97158   145.7   1.774257 1.112669          ?        ? 
1 1 1   21   24    9 f 27.89274 1.994550   22.81349    23.0   7.848830 1.112669          ?        ? 
1 1 1   21   24   10 o 29.47551 2.040484   27.44513   185.0   8.781067 1.202886          ?        ? 
1 1 1   21   24   11 o 35.23961 1.792060   56.80388   296.7   12.54008 1.263030          ?        ? 
1 1 1   21   24   12 o 10.46813 3.789433   5.012739   147.2  0.9923807 1.022453          ?        ? 
1 1 1   21   24   13 o 42.03986 1.323351   50.09570   177.9   17.83278 1.112669          ?        ? 
1 1 1   21   24   14 o 25.77213 1.925298   28.07002   262.5   6.796305 0.9923807          ?        ? 
1 1 1   21   24   15 o 42.42327 1.453162   42.30643     3.8   18.28386 1.232958          ?        ? 
1 1 1   21   24   16 o 30.82335 1.707350   32.91002   210.3   9.773447 1.052525          ?        ? 
1 1 1   21   24   17 f 11.64771 3.551014   11.88966   128.8   1.623896 0.9021643          ?        ? 
1 1 1   21   25    0 o 59.17788 2.037953   35.02287     0.0   35.21448 2.405771   35.21448 2.405771 
1 1 1   21   25    1 o 124.2566 1.403696   144.6470    23.0   154.6911 3.488369          ?        ? 
1 1 1   21   25    2 o 56.37968 1.386804   53.14258   193.1   31.84640 1.563751          ?        ? 
1 1 1   21   25    3 o 31.53162 2.002799   46.61542    65.0   9.983953 1.263030          ?        ? 
1 1 1   21   25    4 o 56.31415 1.388418   51.67881   177.2   31.78626 1.563751          ?        ? 
1 1 1   21   25    5 o 85.40858 1.214736   94.25109   312.6   73.07531 2.074978          ?        ? 
1 1 1   21   25    6 o 42.05331 1.859249   50.42531   256.5   17.77264 1.563751          ?        ? 
1 1 1   21   25    7 o 63.30454 1.282606   85.77593   354.2   40.17639 1.623896          ?        ? 
1 1 1   21   25    8 o 27.61062 2.123845   31.14027   352.6   7.698469 1.172814          ?        ? 
1 1 1   21   25    9 o 34.03919 1.722740   42.07376   332.1   11.66799 1.172814          ?        ? 
1 1 1   21   25   10 o 16.45887 3.658805   28.42294    85.4   2.916998 1.172814          ?        ? 
1 1 1   21   25   11 o 12.82660 4.014145   13.37917   250.7   1.744184 1.142741          ?        ? 
1 1 1   21   25   12 o 28.89082 2.081779   33.33108    88.7   8.510417 1.202886          ?        ? 
1 1 1   21   25   13 o 9.703436 3.815437   4.462602   191.4  0.6916593 1.082597          ?        ? 
1 1 1   21   25   14 o 38.01014 1.463648   45.92479   229.1   14.64513 1.112669          ?        ? 
1 1 1   21   25   15 o 21.56041 2.510613   21.28794   160.1   4.901759 1.082597          ?        ? 
1 1 1   21   25   16 o 18.78998 2.640718   19.95217     7.7   3.819162 0.9923807          ?        ? 
1 1 1   21   26    0 o 47.67943 2.058094   61.32652   180.0   22.91497 1.954689   22.91497 1.954689 
1 1 1   21   26    1 o 46.27145 1.559777   58.62551    45.5   21.47151 1.443463          ?        ? 
1 1 1   21   26    2 o 91.77081 1.261597   112.9431   104.2   84.38244 2.315555          ?        ? 
1 1 1   21   26    3 o 96.57059 1.245603   122.5657    61.8   93.43416 2.405771          ?        ? 
1 1 1   21   26    4 o 46.98029 1.504238   28.46335   291.9   22.13310 1.413391          ?        ? 
1 1 1   21   26    5 o 74.43641 1.272593   89.30117    92.5   55.54325 1.894545          ?        ? 
1 1 1   21   26    6 o 45.97056 1.439154   37.92171   161.1   21.20086 1.323174          ?        ? 
1 1 1   21   26    7 o 35.54456 2.072800   38.16168    46.6   12.75059 1.473535          ?        ? 
1 1 1   21   26    8 o 10.99519 4.050789   9.530195   260.2   1.022453 1.172814          ?        ? 
1 1 1   21   26    9 o 7.373520 3.364995   9.472869   287.2 -0.6916593 1.112669          ?        ? 
1 1 1   21   26   10 o 33.49555 1.795591   36.80925    19.5   11.33720 1.202886          ?        ? 
1 1 1   21   26   11 o 11.38089 3.969313   18.52827   231.8   1.263030 1.112669          ?        ? 
1 1 1   21   26   12 o 8.652843 3.677788   14.79999   162.0  0.1503607 1.112669          ?        ? 
1 1 1   21   26   13 o 33.53975 1.838055   42.93972   189.7   11.48756 1.232958          ?        ? 
1 1 1   21   26   14 o 38.03570 1.502196   34.79148   127.4   14.70528 1.142741          ?        ? 
1 1 1   21   26   15 o 16.03776 3.473150   17.26777   278.3   2.947070 1.082597          ?        ? 
1 1 1   21   26   16 o 17.73851 3.165471   26.92328    10.2   3.608657 1.082597          ?        ? 
1 1 1   21   27    0 o 53.39264 2.119347   56.56856   180.0   28.71890 2.255411   28.71890 2.255411 
1 1 1   21   27    1 o 60.55404 1.340865   58.57121   262.7   36.74816 1.623896          ?        ? 
1 1 1   21   27    2 o 19.41725 3.174903   36.15183   122.2   3.819162 1.232958          ?        ? 
1 1 1   21   27    3 o 17.00038 3.886200   5.370893   304.5   3.067359 1.293102          ?        ? 
1 1 1   21   27    4 o 41.59531 1.735127   47.99635   280.5   17.38170 1.443463          ?        ? 
1 1 1   21   27    5 o 26.95465 2.454446   33.29036    10.9   7.337603 1.323174          ?        ? 
1 1 1   21   27    6 o 16.14988 3.863408   38.36880   331.7   2.796710 1.232958          ?        ? 
1 1 1   21   27    7 o 39.56453 1.710176   42.29656   327.9   15.75780 1.353247          ?        ? 
1 1 1   21   27    8 o 32.40808 2.227010   50.76462   223.8   10.64554 1.443463          ?        ? 
1 1 1   21   27    9 o 18.30277 3.493414   23.87109   219.0   3.578585 1.232958          ?        ? 
1 1 1   21   27   10 o 37.44884 1.646190   37.51746   218.7   14.16398 1.232958          ?        ? 
1 1 1   21   27   11 o 28.30482 2.071756   38.15991    81.4   8.179624 1.172814          ?        ? 
1 1 1   21   27   12 o 27.05470 2.334216   32.39629   279.6   7.548109 1.263030          ?        ? 
1 1 1   21   27   13 o 30.42914 2.025949   25.81594   359.8   9.502798 1.232958          ?        ? 
1 1 1   21   27   14 o 12.79696 3.887667   19.74399   257.4   1.894545 1.082597          ?        ? 
1 1 1   21   27   15 o 19.04581 2.999981   20.98502   347.7   3.999595 1.142741          ?        ? 
1 1 1   21   28    0 o 46.10388 2.162673   40.49739   180.0   21.47151 1.984761   21.47151 1.984761 
1 1 1   21   28    1 o 75.34623 1.337050   69.45988     1.4   56.92657 2.014834          ?        ? 
1 1 1   21   28    2 o 22.18573 3.049813   35.92640    99.3   4.991976 1.353247          ?        ? 
1 1 1   21   28    3 o 58.74993 1.330854   71.12678   237.8   34.61304 1.563751          ?        ? 
1 1 1   21   28    4 o 45.24150 1.595286   53.98492   272.6   20.56935 1.443463          ?        ? 
1 1 1   21   28    5 o 54.91101 1.396513   62.01576   286.2   30.28265 1.533679          ?        ? 
1 1 1   21   28    6 o 11.36911 4.110746   27.02105   322.6   1.142741 1.202886          ?        ? 
1 1 1   21   28    7 o 14.38921 4.090387   24.00854    14.0   2.225339 1.232958          ?        ? 
1 1 1   21   28    8 o 29.93670 2.109502   27.31460   347.7   9.081788 1.263030          ?        ? 
1 1 1   21   28    9 f 18.61835 2.988099   28.86756   308.9   3.578585 1.112669          ?        ? 
1 1 1   21   28   10 o 10.65972 4.061582   2.931100    69.0  0.9322364 1.202886          ?        ? 
1 1 1   21   28   11 o 11.12356 4.055378   12.06002   193.9   1.172814 1.172814          ?        ? 
1 1 1   21   28   12 o 24.23882 2.667419   24.01825   106.1   6.134717 1.293102          ?        ? 
1 1 1   21   28   13 o 9.104575 3.818139   9.363935   304.9  0.3608657 1.172814          ?        ? 
1 1 1   21   28   14 o 30.66417 2.059456   33.64520   137.2   9.773447 1.263030          ?        ? 
1 1 1   21   28   15 o 16.78766 3.342956   20.71684    14.1   3.277864 1.082597          ?        ? 
1 1 1   21   29    0 o 15.62834 5.885607   36.27590   360.0   3.368080 1.714112   3.368080 1.714112 
1 1 1   21   29    1 o 55.16268 1.444658   60.65500     3.9   30.55330 1.593824          ?        ? 
1 1 1   21   29    2 o 56.20726 1.417809   68.41989   345.0   31.72611 1.593824          ?        ? 
1 1 1   21   29    3 o 77.55873 1.318295   98.19001   253.2   60.38487 2.044906          ?        ? 
1 1 1   21   29    4 o 22.69672 2.649912   31.46751   308.4   5.232553 1.202886          ?        ? 
1 1 1   21   29    5 o 24.31872 2.658656   20.61403    29.0   6.014429 1.293102          ?        ? 
1 1 1   21   29    6 f 11.38665 4.157400   9.042660   109.2   1.142741 1.232958          ?        ? 
1 1 1   21   29    7 o 38.00159 1.820080   38.75771   238.2   14.58499 1.383319          ?        ? 
1 1 1   21   29    8 o 51.63395 1.426905   45.64630   176.4   26.85443 1.473535          ?        ? 
1 1 1   21   29    9 o 36.25801 1.824665   41.29455    88.3   13.32196 1.323174          ?        ? 
1 1 1   21   29   10 o 24.67805 2.071584   27.02399   137.6   6.224934 1.022453          ?        ? 
1 1 1   21   29   11 o 15.51085 3.960240   13.78815   291.6   2.736565 1.232958          ?        ? 
1 1 1   21   29   12 o 13.76922 4.262271   17.08255    29.3   2.165194 1.293102          ?        ? 
1 1 1   21   29   13 o 34.24673 1.800111   39.94580    98.8   12.05893 1.232958          ?        ? 
1 1 1   21   29   14 o 12.16208 4.134799   14.95464   357.3   1.774257 1.202886          ?        ? 
1 1 1   21   30    0 o 37.83572 2.689953   54.71682    -0.0   14.64513 2.014834   14.64513 2.014834 
1 1 1   21   30    1 o 27.00891 2.505185   20.41996   327.2   7.397748 1.353247          ?        ? 
1 1 1   21   30    2 o 36.30133 1.946748   55.49245   239.9   13.29189 1.413391          ?        ? 
1 1 1   21   30    3 o 16.21448 3.853620   24.20440   127.5   2.826782 1.232958          ?        ? 
1 1 1   21   30    4 o 36.69600 1.884836   40.03812   232.3   13.59261 1.383319          ?        ? 
1 1 1   21   30    5 o 10.79209 4.076294   11.93242   306.7  0.9322364 1.202886          ?        ? 
1 1 1   21   30    6 o 8.179596 3.659417   13.38346   211.6 -0.4510822 1.232958          ?        ? 
1 1 1   21   30    7 o 47.87749 1.570265   30.58069     1.4   23.12548 1.503607          ?        ? 
1 1 1   21   30    8 o 54.07445 1.418118   44.00285     7.3   29.47070 1.533679          ?        ? 
1 1 1   21   30    9 o 9.981908 3.990614   13.73109    14.6  0.6615872 1.202886          ?        ? 
1 1 1   21   30   10 o 27.05861 2.445016   25.27022    21.6   7.578181 1.323174          ?        ? 
1 1 1   21   30   11 o 12.82935 4.013973   21.75360   258.5   1.834401 1.142741          ?        ? 
1 1 1   21   30   12 o 8.192527 3.505118  0.7191387   309.1  0.1503607 1.022453          ?        ? 
1 1 1   21   30   13 o 14.84002 3.900238   25.05191    79.7   2.616277 1.172814          ?        ? 
1 1 1   21   30   14 o 8.159856 3.614918   6.844727    86.5   0.000000 1.172814          ?        ? 
1 1 1   21   31    0 o 41.20190 2.687428   40.34255    -0.0   17.35163 2.195267   17.35163 2.195267 
1 1 1   21   31    1 o 26.81370 2.467348   36.58501    28.0   7.307531 1.323174          ?        ? 
1 1 1   21   31    2 o 13.04939 4.385611   4.509071   358.7   1.714112 1.353247          ?        ? 
1 1 1   21   31    3 o 29.10226 2.324985   28.63953    92.2   8.600634 1.353247          ?        ? 
1 1 1   21   31    4 o 31.77981 2.271038   33.50777   223.7   10.25460 1.443463          ?        ? 
1 1 1   21   31    5 o 8.168262 3.656751   13.86456   319.9 -0.4510822 1.232958          ?        ? 
1 1 1   21   31    6 o 12.95747 4.287044   7.386716    64.0   1.744184 1.293102          ?        ? 
1 1 1   21   31    7 o 45.31606 1.725383   52.27597   226.2   20.77985 1.563751          ?        ? 
1 1 1   21   31    8 o 35.69090 1.853658   22.42779    49.7   12.96109 1.323174          ?        ? 
1 1 1   21   31    9 o 12.50214 4.286828   21.28249   313.3   1.653968 1.293102          ?        ? 
1 1 1   21   31   10 o 15.38182 4.119685   29.54355    22.3   2.706493 1.293102          ?        ? 
1 1 1   21   31   11 o 14.73795 4.124129   18.53705    25.6   2.526060 1.263030          ?        ? 
1 1 1   21   31   12 o 13.71533 4.084261   18.87430   239.4   2.225339 1.202886          ?        ? 
1 1 1   21   31   13 o 25.45452 2.303744   30.65237   295.7   6.886521 1.172814          ?        ? 
1 1 1   21   32    0 o 9.574407 5.640859   1.542566   180.0   1.202886 1.804329   1.202886 1.804329 
1 1 1   21   32    1 o 37.53698 1.962778   52.23084   136.0   14.25420 1.473535          ?        ? 
1 1 1   21   32    2 o 28.20865 2.558547   18.65101    63.8   8.119479 1.443463          ?        ? 
1 1 1   21   32    3 o 21.29655 2.894736   41.92258    96.7   4.661182 1.232958          ?        ? 
1 1 1   21   32    4 o 29.13617 2.373886   21.79794   130.2   8.660777 1.383319          ?        ? 
1 1 1   21   32    5 o 50.58082 1.516068   67.73470   323.3   25.80190 1.533679          ?        ? 
1 1 1   21   32    6 o 30.60263 2.210998   27.38212   205.6   9.562942 1.353247          ?        ? 
1 1 1   21   32    7 o 20.18875 3.277009   26.06121   125.7   4.300317 1.323174          ?        ? 
1 1 1   21   32    8 o 17.39738 3.737441   20.13734   221.4   3.368080 1.263030          ?        ? 
1 1 1   21   32    9 o 18.55216 3.613989   18.29824    34.1   3.819162 1.293102          ?        ? 
1 1 1   21   32   10 o 9.392126 3.951576   9.635286     7.5  0.3608657 1.263030          ?        ? 
1 1 1   21   32   11 o 12.23727 4.278003   17.29563   211.9   1.684040 1.293102          ?        ? 
1 1 1   21   32   12 o 10.04214 3.998556   16.30368   261.6  0.9021643 1.202886          ?        ? 
1 1 1   21   32   13 o 13.68886 4.021514   13.18813    24.9   2.345627 1.172814          ?        ? 
1 1 1   21   33    0 o 12.17190 6.222743   18.51078     0.0   2.345627 1.894545   2.345627 1.894545 
1 1 1   21   33    1 f 37.41164 1.969354   44.85587   147.9   14.19405 1.473535          ?        ? 
1 1 1   21   33    2 o 11.35142 4.239671   19.65794    24.3   1.112669 1.293102          ?        ? 
1 1 1   21   33    3 o 49.56235 1.638235   60.81179    43.4   24.80952 1.623896          ?        ? 
1 1 1   21   33    4 o 11.30199 4.273381   11.12477   136.7   1.082597 1.323174          ?        ? 
1 1 1   21   33    5 o 33.93491 2.082502   33.29193   205.4   11.75821 1.413391          ?        ? 
1 1 1   21   33    6 o 9.245791 3.923704   9.881700    43.0  0.2105050 1.263030          ?        ? 
1 1 1   21   33    7 o 32.63684 2.073189   33.37251   171.7   10.91619 1.353247          ?        ? 
1 1 1   21   33    8 o 28.44096 2.326178   29.36373    98.5   8.360056 1.323174          ?        ? 
1 1 1   21   33    9 o 10.96497 4.201440   27.08703   114.5   1.082597 1.293102          ?        ? 
1 1 1   21   33   10 o 40.50484 1.818962   51.65438   132.8   16.87047 1.473535          ?        ? 
1 1 1   21   33   11 o 36.62555 1.888461   42.16133   144.4   13.89333 1.383319          ?        ? 
1 1 1   21   33   12 o 17.29178 4.064104   27.70923   315.6   3.698874 1.383319          ?        ? 
1 1 1   21   34    0 o 54.94114 2.141746   63.71707    -0.0   30.61344 2.345627   30.61344 2.345627 
1 1 1   21   34    1 o 30.37574 2.326512   26.97504    44.5   9.442654 1.413391          ?        ? 
1 1 1   21   34    2 o 9.836353 4.059618   7.291257   132.5  0.4510822 1.293102          ?        ? 
1 1 1   21   34    3 o 42.57221 1.765949   49.41545   155.4   18.40415 1.503607          ?        ? 
1 1 1   21   34    4 o 29.49596 2.548836   32.06638   117.2   8.991571 1.503607          ?        ? 
1 1 1   21   34    5 o 8.686422 3.861334   3.733022   248.9 -0.3007214 1.353247          ?        ? 
1 1 1   21   34    6 o 10.30260 4.098862   9.478063    89.3  0.7818757 1.263030          ?        ? 
1 1 1   21   34    7 o 13.99938 4.422966   1.357412   220.2   2.225339 1.383319          ?        ? 
1 1 1   21   34    8 o 54.07644 1.473677   52.51967   306.7   29.68121 1.593824          ?        ? 
1 1 1   21   34    9 o 36.12344 1.956335   39.87922   168.1   13.47232 1.413391          ?        ? 
1 1 1   21   34   10 o 14.90735 4.300748   18.55218   131.3   2.706493 1.353247          ?        ? 
1 1 1   21   34   11 f 21.68184 2.981994   23.72743   161.8   5.202481 1.293102          ?        ? 
1 1 1   21   35    0 o 6.058279 4.258062   3.927720   180.0  -1.533679 1.864473  -1.533679 1.864473 
1 1 1   21   35    1 o 12.26845 4.323683   10.83743   322.4   1.533679 1.323174          ?        ? 
1 1 1   21   35    2 o 45.27231 1.793476   45.35831   142.2   20.84000 1.623896          ?        ? 
1 1 1   21   35    3 o 9.943219 4.074193   9.822812   163.0  0.5412986 1.293102          ?        ? 
1 1 1   21   35    4 o 25.98942 2.892729   17.85312   331.3   7.097026 1.503607          ?        ? 
1 1 1   21   35    5 o 22.18258 3.185813   11.70606     3.3   5.232553 1.413391          ?        ? 
1 1 1   21   35    6 o 11.58853 4.373038   16.46923   103.1   1.263030 1.383319          ?        ? 
1 1 1   21   35    7 o 7.466984 3.508806   12.78532   219.9  -1.172814 1.353247          ?        ? 
1 1 1   21   35    8 o 22.10938 2.992337   9.724376    78.0   5.262625 1.323174          ?        ? 
1 1 1   21   35    9 o 45.90445 1.703268   40.84896   357.6   21.65195 1.563751          ?        ? 
1 1 1   21   35   10 o 14.52890 4.333129   20.67058   272.9   2.676421 1.353247          ?        ? 
1 1 1   21   36    0 o 7.411226 4.966939   16.47310   180.0 -0.3007214 1.984761 -0.3007214 1.984761 
1 1 1   21   36    1 o 13.90199 4.313198   7.224378    15.3   2.195267 1.323174          ?        ? 
1 1 1   21   36    2 o 8.725656 3.963103   10.46542    57.8 -0.5713707 1.503607          ?        ? 
1 1 1   21   36    3 o 22.79675 3.231898   30.43420   282.9   5.533275 1.473535          ?        ? 
1 1 1   21   36    4 o 30.06320 2.350699   26.54856   115.0   9.352437 1.413391          ?        ? 
1 1 1   21   36    5 o 16.58471 4.377753   17.72691   115.1   3.217719 1.473535          ?        ? 
1 1 1   21   36    6 o 23.34320 2.898588   23.26693    53.7   5.803924 1.353247          ?        ? 
1 1 1   21   36    7 o 34.33139 2.233640   30.57365   282.0   12.29951 1.533679          ?        ? 
1 1 1   21   36    8 o 23.12843 3.055528   25.59943   224.3   5.833996 1.413391          ?        ? 
1 1 1   21   36    9 o 23.86688 3.023988   25.13893    53.8   6.315150 1.443463          ?        ? 
1 1 1   21   36   10 o 18.65322 3.913582   17.63923   128.5   4.270245 1.413391          ?        ? 
1 1 1   21   37    0 o 6.308929 4.381126   15.34416     0.0  -1.022453 1.804329  -1.022453 1.804329 
1 1 1   21   37    1 o 9.897992 4.123055   8.663866   136.7  0.4811543 1.353247          ?        ? 
1 1 1   21   37    2 o 20.03710 3.814353   22.98513   310.8   4.510822 1.473535          ?        ? 
1 1 1   21   37    3 o 13.31009 4.574957   12.75217   343.5   1.984761 1.473535          ?        ? 
1 1 1   21   37    4 o 25.23087 2.860510   25.06957   171.5   6.766232 1.443463          ?        ? 
1 1 1   21   37    5 o 9.894588 4.122435   6.072566   229.0  0.5713707 1.353247          ?        ? 
1 1 1   21   37    6 o 7.892114 3.699346   10.43355   189.3  -1.052525 1.473535          ?        ? 
1 1 1   21   37    7 o 9.041736 3.991730   15.34641   110.1       0.06 1.413391          ?        ? 
1 1 1   21   37    8 o 9.220589 4.055437   10.86492   277.8  0.2105050 1.443463          ?        ? 
1 1 1   21   37    9 o 27.59439 2.724479   32.64989    52.7   8.360056 1.503607          ?        ? 
1 1 1   21   38    0 o 17.44615 6.505010   10.18247   180.0   4.540894 2.105050   4.540894 2.105050 
1 1 1   21   38    1 o 25.65196 2.813553   21.20933   214.1   7.006810 1.443463          ?        ? 
1 1 1   21   38    2 o 29.07681 2.585578   40.97876   105.5   8.931427 1.503607          ?        ? 
1 1 1   21   38    3 o 14.82481 4.597558   10.97100   338.3   2.676421 1.503607          ?        ? 
1 1 1   21   38    4 o 14.68518 4.438254   13.91553   181.6   2.616277 1.413391          ?        ? 
1 1 1   21   38    5 o 14.23774 4.520128   16.59648   147.3   2.495988 1.443463          ?        ? 
1 1 1   21   38    6 o 10.83871 4.328480   14.09538    90.6   1.142741 1.413391          ?        ? 
1 1 1   21   38    7 o 7.770807 3.626578   9.446932   203.4 -0.7518036 1.383319          ?        ? 
1 1 1   21   39    0 o 11.42170 6.287878   7.864955     0.0   2.315555 2.044906   2.315555 2.044906 
1 1 1   21   39    1 o 24.76948 3.156610   20.60202   354.0   6.706088 1.563751          ?        ? 
1 1 1   21   39    2 o 17.91839 4.323059   8.105192   313.7   3.909379 1.533679          ?        ? 
1 1 1   21   39    3 o 28.99476 2.644753   16.54434   172.4   9.021644 1.533679          ?        ? 
1 1 1   21   39    4 o 10.08800 4.233441   12.71064   325.3  0.7217315 1.443463          ?        ? 
1 1 1   21   39    5 o 18.32668 4.046483   20.00851   233.1   4.119884 1.443463          ?        ? 
1 1 1   21   39    6 o 12.07670 4.485567   11.56456   174.5   1.774257 1.443463          ?        ? 
1 1 1   21   40    0 o 6.257957 4.423079   5.446167     0.0  -1.503607 2.074978  -1.503607 2.074978 
1 1 1   21   40    1 o 15.57583 4.606081   16.37673   201.4   3.157575 1.533679          ?        ? 
1 1 1   21   40    2 o 13.93026 4.529438   23.46777   266.9   2.495988 1.443463          ?        ? 
1 1 1   21   40    3 o 19.63944 3.889804   15.91164    19.6   4.661182 1.473535          ?        ? 
1 1 1   21   40    4 o 10.75839 4.315432   12.46990   103.6   1.172814 1.413391          ?        ? 
1 1 1   22    0    0 o 194.9854 2.900917   207.1513   180.0   380.6833 11.30713   380.6833 11.30713 
1 1 1   22    0    1 o 12.82593 3.902129   51.23622     0.0   2.044906 0.8720922   2.044906 0.8720922 
1 1 1   22    0    2 o 150.7983 1.665610   215.8845   180.0   227.5860 5.022048   227.5860 5.022048 
1 1 1   22    0    3 o 109.5951 1.331248   160.2061     0.0   120.1984 2.916998   120.1984 2.916998 
1 1 1   22    0    4 o 50.65398 1.248406   111.1125   180.0   25.71168 1.263030   25.71168 1.263030 
1 1 1   22    0    5 o 19.21211 2.493174   36.24855     0.0   3.879307 0.9322364   3.879307 0.9322364 
1 1 1   22    0    6 f 49.75783 1.210330   66.88580     0.0   24.80952 1.202886   24.80952 1.202886 
1 1 1   22    0    7 o 6.762994 3.775910   74.37971   180.0  0.6315150 0.7518036  0.6315150 0.7518036 
1 1 1   22    0    8 o 19.57374 1.875422   54.00401   180.0   3.939451 0.7217315   3.939451 0.7217315 
1 1 1   22    0    9 o 5.553268 3.217208   33.84535   180.0  0.3909379 0.5713707  0.3909379 0.5713707 
1 1 1   22    0   10 o 49.07049 1.012138   18.93697     0.0   24.11786 0.9923807   24.11786 0.9923807 
1 1 1   22    0   11 f 107.7459 3.061630   128.3922     0.0   116.7701 6.585800   116.7701 6.585800 
1 1 1   22    0   12 x        ?      ?   58.98940     0.0          ?        ?          ?        ? 
1 1 1   22    0   13 o 41.91142 2.714002   49.95209   180.0   17.86285 2.255411   17.86285 2.255411 
1 1 1   22    0   14 o 16.86505 5.695796   11.81607   180.0   3.728946 1.714112   3.728946 1.714112 
1 1 1   22    0   15 x        ?      ?   20.78728     0.0          ?        ?          ?        ? 
1 1 1   22    0   16 x        ?      ?   34.39352     0.0          ?        ?          ?        ? 
1 1 1   22    0   17 x        ?      ?   32.56652     0.0          ?        ?          ?        ? 
1 1 1   22    0   18 x        ?      ?   1.710068   180.0          ?        ?          ?        ? 
1 1 1   22    0   19 o 24.07208 4.772662   20.48593     0.0   6.826377 2.044906   6.826377 2.044906 
1 1 1   22    0   20 o 6.214946 4.500347   14.41540   180.0  -3.518441 2.706493  -3.518441 2.706493 
1 1 1   22    1    0 o 75.64456 1.312783   134.3071   180.0   57.28744 1.984761   57.28744 1.984761 
1 1 1   22    1    1 o 96.69510 0.9329991   141.0186   230.8   93.52437 1.804329          ?        ? 
1 1 1   22    1    2 o 109.9045 1.012397   145.6611   334.2   120.8299 2.225339          ?        ? 
1 1 1   22    1    3 o 77.85242 0.8884237   119.2983   141.8   60.62545 1.383319          ?        ? 
1 1 1   22    1    4 o 61.49911 0.8557238   76.68206    96.9   37.83076 1.052525          ?        ? 
1 1 1   22    1    5 f 114.7558 1.008905   167.8121   150.9   131.7461 2.315555          ?        ? 
1 1 1   22    1    6 o 10.36513 2.824781   30.25164   131.1   1.112669 0.6014429          ?        ? 
1 1 1   22    1    7 o 98.73492 0.8984950   134.5270     9.9   97.52396 1.774257          ?        ? 
1 1 1   22    1    8 o 44.37545 0.7115591   84.76485   346.5   19.69725 0.6315150          ?        ? 
1 1 1   22    1    9 o 60.00995 0.8519028   53.11700   283.9   36.02643 1.022453          ?        ? 
1 1 1   22    1   10 o 109.1717 1.198239   140.6725   326.2   119.2962 2.616277          ?        ? 
1 1 1   22    1   11 o 35.64885 1.138814   54.07175   298.0   12.72052 0.8119479          ?        ? 
1 1 1   22    1   12 o 33.59382 3.983502   45.52879    66.7   11.45749 2.676421          ?        ? 
1 1 1   22    1   13 o 40.13344 3.596659   46.16438   129.5   16.35925 2.886926          ?        ? 
1 1 1   22    1   14 o 37.80880 2.505429   45.79229   239.4   14.43463 1.894545          ?        ? 
1 1 1   22    1   15 o 13.00357 4.939153   37.17336    81.3   1.353247 1.774257          ?        ? 
1 1 1   22    1   16 o 40.84685 2.429516   54.71439   259.0   16.99076 1.984761          ?        ? 
1 1 1   22    1   17 o 18.54688 6.833809   23.27362   145.9   3.909379 3.338008          ?        ? 
1 1 1   22    1   18 o 41.32146 1.091642   55.85646   201.4   17.20127 0.9021643          ?        ? 
1 1 1   22    1   19 o 8.362022 3.299099   13.71538   239.2  0.5112265 0.8119479          ?        ? 
1 1 1   22    1   20 o 10.60018 3.691926   18.46364   238.0   1.263030 0.9623086          ?        ? 
1 1 1   22    2    0 o 104.5396 1.366922   115.4917    -0.0   109.3724 2.856854   109.3724 2.856854 
1 1 1   22    2    1 o 108.9993 0.9932144   153.0108    18.2   118.8451 2.165194          ?        ? 
1 1 1   22    2    2 o 199.0940 1.442480   250.0443   342.1   396.6516 5.743780          ?        ? 
1 1 1   22    2    3 o 111.0332 1.029189   152.6429     1.0   123.3259 2.285483          ?        ? 
1 1 1   22    2    4 o 133.2211 1.049649   179.8009   318.8   177.5459 2.796710          ?        ? 
1 1 1   22    2    5 o 154.4282 1.178130   231.1986   308.6   238.6225 3.638730          ?        ? 
1 1 1   22    2    6 o 45.11399 0.8665558   51.19208   258.9   20.35884 0.7818757          ?        ? 
1 1 1   22    2    7 o 4.934103 2.289466   8.424288    40.1 -0.4811543 0.5412986          ?        ? 
1 1 1   22    2    8 o 38.84526 0.8902750   44.91800    74.8   15.09622 0.6916593          ?        ? 
1 1 1   22    2    9 o 40.58205 1.074480   57.24124    49.1   16.47953 0.8720922          ?        ? 
1 1 1   22    2   10 o 24.44087 1.661045   34.90733   148.1   5.984357 0.8119479          ?        ? 
1 1 1   22    2   11 o 51.58027 1.399240   36.35581   114.6   26.64392 1.443463          ?        ? 
1 1 1   22    2   12 o 38.07446 1.421684   72.49876   163.8   14.52485 1.082597          ?        ? 
1 1 1   22    2   13 o 24.12379 1.433563   22.08956   228.5   5.833996 0.6916593          ?        ? 
1 1 1   22    2   14 o 45.54739 1.023370   54.65236   302.3   20.77985 0.9322364          ?        ? 
1 1 1   22    2   15 o 38.73045 1.009381   52.62526    79.9   15.03607 0.7818757          ?        ? 
1 1 1   22    2   16 o 46.19873 1.008942   59.47709   162.8   21.41137 0.9322364          ?        ? 
1 1 1   22    2   17 o 23.39872 1.542246   33.66456   191.4   5.533275 0.7217315          ?        ? 
1 1 1   22    2   18 o 34.03433 1.413732   37.68824   108.1   11.72814 0.9623086          ?        ? 
1 1 1   22    2   19 o 9.173820 3.511012   14.54892   312.2  0.7217315 0.9021643          ?        ? 
1 1 1   22    2   20 o 16.85929 3.055527   31.18796   347.1   3.217719 0.9923807          ?        ? 
1 1 1   22    3    0 o 49.47547 1.339374   75.29404   360.0   24.53887 1.323174   24.53887 1.323174 
1 1 1   22    3    1 o 18.26065 1.811510   69.75474    61.2   3.338008 0.6615872          ?        ? 
1 1 1   22    3    2 o 108.2377 0.9863115   166.8211   265.4   117.1912 2.135122          ?        ? 
1 1 1   22    3    3 o 171.4768 1.271443   204.7001   337.2   294.1958 4.360461          ?        ? 
1 1 1   22    3    4 o 65.79774 0.8226705   114.9886   168.4   43.30389 1.082597          ?        ? 
1 1 1   22    3    5 o 41.53959 0.9049244   46.13156   205.2   17.26141 0.7518036          ?        ? 
1 1 1   22    3    6 o 66.34229 0.8385823   100.8427   143.2   44.02562 1.112669          ?        ? 
1 1 1   22    3    7 o 70.49059 0.9172163   103.7079   173.9   49.70926 1.293102          ?        ? 
1 1 1   22    3    8 o 103.8807 1.114526   137.3643   183.4   107.9891 2.315555          ?        ? 
1 1 1   22    3    9 o 110.9448 1.138431   134.2551   182.2   123.1755 2.526060          ?        ? 
1 1 1   22    3   10 o 61.48637 1.002627   91.35657   159.3   37.83076 1.232958          ?        ? 
1 1 1   22    3   11 o 67.64776 1.400301   97.68356   173.8   45.82995 1.894545          ?        ? 
1 1 1   22    3   12 o 19.08424 2.757577   40.85855    53.5   3.668802 1.052525          ?        ? 
1 1 1   22    3   13 f 72.35364 1.413133   74.86111   186.6   52.47589 2.044906          ?        ? 
1 1 1   22    3   14 o 15.54309 2.913030   31.85726   106.1   2.526060 0.8720922          ?        ? 
1 1 1   22    3   15 o 45.93652 1.178362   66.07150    82.9   21.17079 1.082597          ?        ? 
1 1 1   22    3   16 o 28.00744 1.610580   40.12840    81.9   7.908974 0.9021643          ?        ? 
1 1 1   22    3   17 o 47.08632 1.181521   54.47590   323.7   22.31353 1.112669          ?        ? 
1 1 1   22    3   18 o 7.563297 3.206385   6.311596   284.9  0.1202886 0.8420200          ?        ? 
1 1 1   22    3   19 o 7.525708 3.284809   12.01487   327.2      -0.03 0.9322364          ?        ? 
1 1 1   22    3   20 o 21.57767 2.369238   25.90239   272.6   4.961904 1.022453          ?        ? 
1 1 1   22    4    0 o 112.4875 1.404012   125.9348   180.0   126.6338 3.157575   126.6338 3.157575 
1 1 1   22    4    1 o 62.73351 0.8628541   110.0590   259.1   39.36444 1.082597          ?        ? 
1 1 1   22    4    2 f 156.7718 1.256428   208.2175   239.5   245.8999 3.939451          ?        ? 
1 1 1   22    4    3 o 46.39605 0.9074266   100.2928   153.5   21.53165 0.8420200          ?        ? 
1 1 1   22    4    4 o 69.09377 0.9139969   89.47998   179.2   47.75457 1.263030          ?        ? 
1 1 1   22    4    5 o 40.69613 1.071468   52.99689   117.5   16.56975 0.8720922          ?        ? 
1 1 1   22    4    6 o 36.89875 1.140987   24.00198   194.9   13.62268 0.8420200          ?        ? 
1 1 1   22    4    7 o 26.51646 1.304208   40.52897   251.8   7.036882 0.6916593          ?        ? 
1 1 1   22    4    8 o 83.83944 1.076062   98.33024   212.2   70.33875 1.804329          ?        ? 
1 1 1   22    4    9 o 72.66742 1.034582   100.1168   314.0   52.83676 1.503607          ?        ? 
1 1 1   22    4   10 o 9.878544 3.452244   17.99804   257.4  0.8720922 0.8420200          ?        ? 
1 1 1   22    4   11 o 81.20673 1.351653   83.45135   101.9   66.03843 2.195267          ?        ? 
1 1 1   22    4   12 o 39.18733 1.649899   58.33601    42.4   15.39694 1.293102          ?        ? 
1 1 1   22    4   13 o 96.72257 1.274737   112.7503    63.3   93.73488 2.465916          ?        ? 
1 1 1   22    4   14 o 27.71465 2.441393   30.20013    12.8   7.758613 1.353247          ?        ? 
1 1 1   22    4   15 o 18.05220 2.498765   34.60270   201.5   3.307936 0.9021643          ?        ? 
1 1 1   22    4   16 o 59.83604 1.181053   75.28822   193.1   35.96629 1.413391          ?        ? 
1 1 1   22    4   17 o 19.79806 2.430311   29.85180    71.2   4.029667 0.9623086          ?        ? 
1 1 1   22    4   18 o 11.12870 3.640029   17.94932    81.1   1.323174 0.9322364          ?        ? 
1 1 1   22    4   19 o 16.42892 3.043050   16.85144   183.9   2.977142 0.9623086          ?        ? 
1 1 1   22    4   20 o 7.263646 3.265360   15.42095   178.9 -0.2105050 0.9923807          ?        ? 
1 1 1   22    5    0 o 136.4247 1.576549   168.4333   360.0   186.2669 4.300317   186.2669 4.300317 
1 1 1   22    5    1 o 66.68204 0.9019563   89.35746   359.1   44.47670 1.202886          ?        ? 
1 1 1   22    5    2 o 153.1491 1.187970   195.2811    48.9   234.6529 3.638730          ?        ? 
1 1 1   22    5    3 o 74.51471 1.008933   78.01617    99.3   55.54325 1.503607          ?        ? 
1 1 1   22    5    4 o 28.11102 1.444181   57.14765   236.1   7.908974 0.8119479          ?        ? 
1 1 1   22    5    5 o 37.82474 1.113055   55.73073   269.6   14.31434 0.8420200          ?        ? 
1 1 1   22    5    6 o 69.15640 0.9349115   79.89697    40.5   47.84478 1.293102          ?        ? 
1 1 1   22    5    7 o 34.93230 1.076087   32.45067   263.7   12.20929 0.7518036          ?        ? 
1 1 1   22    5    8 o 13.55923 3.252718   21.38264   271.8   1.924617 0.8720922          ?        ? 
1 1 1   22    5    9 o 64.65573 1.069757   75.23325     9.3   41.83036 1.383319          ?        ? 
1 1 1   22    5   10 o 55.55089 1.109755   57.49682    55.5   30.88409 1.232958          ?        ? 
1 1 1   22    5   11 o 21.51607 2.935086   4.911514    34.7   4.661182 1.263030          ?        ? 
1 1 1   22    5   12 o 104.1049 1.415433   118.6918   320.7   108.5905 2.947070          ?        ? 
1 1 1   22    5   13 o 38.43431 1.721346   41.29901   295.2   14.82557 1.323174          ?        ? 
1 1 1   22    5   14 o 34.15157 2.113319   45.67432   102.9   11.75821 1.443463          ?        ? 
1 1 1   22    5   15 o 41.84252 1.617071   55.80914    37.0   17.62228 1.353247          ?        ? 
1 1 1   22    5   16 o 34.30115 1.446571   46.16293    72.4   11.84843 0.9923807          ?        ? 
1 1 1   22    5   17 o 15.34700 3.504643   18.15969    51.5   2.586205 1.052525          ?        ? 
1 1 1   22    5   18 o 20.53658 2.562561   30.41571   298.3   4.390533 1.052525          ?        ? 
1 1 1   22    5   19 o 12.37929 3.492482   11.10018   193.3   1.744184 0.9021643          ?        ? 
1 1 1   22    5   20 o 13.02667 3.938073   20.11558    18.4   2.074978 1.112669          ?        ? 
1 1 1   22    6    0 o 69.83831 1.292779   57.48560     0.0   48.83716 1.804329   48.83716 1.804329 
1 1 1   22    6    1 o 34.32634 1.182689   62.09398   128.0   11.78828 0.8119479          ?        ? 
1 1 1   22    6    2 o 54.69165 1.017221   74.87543   182.2   29.92178 1.112669          ?        ? 
1 1 1   22    6    3 o 79.05624 0.9699926   125.6239   315.7   62.51999 1.533679          ?        ? 
1 1 1   22    6    4 o 76.69752 1.019428   73.24051   202.5   58.85118 1.563751          ?        ? 
1 1 1   22    6    5 o 105.4592 1.069329   121.2244    65.8   111.2669 2.255411          ?        ? 
1 1 1   22    6    6 o 93.34694 1.014787   132.6210   110.3   87.17915 1.894545          ?        ? 
1 1 1   22    6    7 o 93.84473 1.009404   129.5206    66.4   88.11138 1.894545          ?        ? 
1 1 1   22    6    8 f 17.04624 2.558019   28.74161   127.5   2.916998 0.8720922          ?        ? 
1 1 1   22    6    9 o 41.85230 1.257428   59.47802    91.3   17.53206 1.052525          ?        ? 
1 1 1   22    6   10 o 24.06151 1.937195   28.21110   307.9   5.803924 0.9322364          ?        ? 
1 1 1   22    6   11 o 79.46478 1.116379   109.3534   228.1   63.21165 1.774257          ?        ? 
1 1 1   22    6   12 o 54.66991 1.457679   82.22994   290.6   29.95186 1.593824          ?        ? 
1 1 1   22    6   13 o 18.58237 3.359843   36.21218   156.9   3.608657 1.202886          ?        ? 
1 1 1   22    6   14 o 45.79782 1.805728   62.83113   233.4   21.11065 1.653968          ?        ? 
1 1 1   22    6   15 o 54.88871 1.534050   77.24942   256.5   30.31272 1.684040          ?        ? 
1 1 1   22    6   16 o 16.12060 4.167722   25.47091   213.8   2.856854 1.353247          ?        ? 
1 1 1   22    6   17 o 12.54318 3.837850   16.26676   139.2   1.714112 1.052525          ?        ? 
1 1 1   22    6   18 o 9.155736 3.702626   9.240398   135.8  0.5112265 1.052525          ?        ? 
1 1 1   22    6   19 f 28.42439 2.010142   38.41531   328.0   8.360056 1.142741          ?        ? 
1 1 1   22    6   20 o 14.68582 3.918923   10.76956   351.5   2.646349 1.172814          ?        ? 
1 1 1   22    7    0 o 21.71919 2.952048   28.47874     0.0   4.841615 1.263030   4.841615 1.263030 
1 1 1   22    7    1 f 28.00620 1.449586   56.61054   112.3   7.848830 0.8119479          ?        ? 
1 1 1   22    7    2 o 33.75027 1.291978   37.41368   239.1   11.39734 0.8720922          ?        ? 
1 1 1   22    7    3 o 91.82087 1.113530   121.2580    22.7   84.35236 2.044906          ?        ? 
1 1 1   22    7    4 o 48.97606 1.043829   101.2325   272.8   23.99757 1.022453          ?        ? 
1 1 1   22    7    5 o 139.0558 1.232680   191.5620   292.5   193.4842 3.428224          ?        ? 
1 1 1   22    7    6 o 33.65889 1.206142   15.23390   227.5   11.33720 0.8119479          ?        ? 
1 1 1   22    7    7 f 72.48962 0.8296952   93.61089    29.8   52.56611 1.202886          ?        ? 
1 1 1   22    7    8 o 27.61203 1.797008   16.76419    88.0   7.638325 0.9923807          ?        ? 
1 1 1   22    7    9 o 37.65284 1.397670   31.45890   248.7   14.19405 1.052525          ?        ? 
1 1 1   22    7   10 o 53.86794 1.283991   59.13193   117.1   29.04969 1.383319          ?        ? 
1 1 1   22    7   11 o 47.00901 1.343391   68.40746   157.7   22.13310 1.263030          ?        ? 
1 1 1   22    7   12 o 78.51926 1.321318   96.30982   198.9   61.76818 2.074978          ?        ? 
1 1 1   22    7   13 o 23.31401 2.966711   42.06597   345.8   5.503202 1.383319          ?        ? 
1 1 1   22    7   14 o 67.56881 1.446444   86.93494   230.4   45.86002 1.954689          ?        ? 
1 1 1   22    7   15 o 34.43023 1.877859   45.76567   119.1   11.96871 1.293102          ?        ? 
1 1 1   22    7   16 o 10.15090 4.220110   5.459387   167.8  0.3909379 1.413391          ?        ? 
1 1 1   22    7   17 o 23.51137 2.558094   24.45165   305.4   5.713707 1.202886          ?        ? 
1 1 1   22    7   18 o 10.75346 3.991664   10.28947   319.2   1.082597 1.142741          ?        ? 
1 1 1   22    7   19 o 26.58116 2.319233   41.08375    48.2   7.397748 1.232958          ?        ? 
1 1 1   22    7   20 o 13.78980 3.943621   10.97352    21.5   2.345627 1.142741          ?        ? 
1 1 1   22    8    0 o 98.13842 1.671104   141.3115    -0.0   96.44137 3.277864   96.44137 3.277864 
1 1 1   22    8    1 o 59.78323 1.106644   98.61944    19.7   35.75578 1.323174          ?        ? 
1 1 1   22    8    2 o 31.58655 1.332878   69.14685     7.5   9.983953 0.8420200          ?        ? 
1 1 1   22    8    3 o 54.33010 1.023990   40.64056   119.5   29.53085 1.112669          ?        ? 
1 1 1   22    8    4 o 60.63247 1.016747   89.36494   209.2   36.77823 1.232958          ?        ? 
1 1 1   22    8    5 f 101.7411 1.108407   138.6876   234.2   103.5685 2.255411          ?        ? 
1 1 1   22    8    6 o 75.58907 1.054269   88.13140   305.4   57.16715 1.593824          ?        ? 
1 1 1   22    8    7 o 45.90410 0.8516405   45.78090   186.3   21.08057 0.7818757          ?        ? 
1 1 1   22    8    8 o 67.26864 1.229375   89.88377    76.0   45.28865 1.653968          ?        ? 
1 1 1   22    8    9 o 49.08152 1.347936   56.52252    28.7   24.11786 1.323174          ?        ? 
1 1 1   22    8   10 o 42.55381 1.413370   59.49728    94.8   18.13350 1.202886          ?        ? 
1 1 1   22    8   11 o 29.27584 1.951680   51.90231    70.4   8.600634 1.142741          ?        ? 
1 1 1   22    8   12 o 17.51713 4.029832   5.640479   249.2   3.247792 1.383319          ?        ? 
1 1 1   22    8   13 o 42.83462 1.755131   74.74672   309.5   18.43423 1.503607          ?        ? 
1 1 1   22    8   14 o 30.20200 2.339896   33.61572     3.8   9.232149 1.413391          ?        ? 
1 1 1   22    8   15 o 51.23182 1.584851   57.29925    30.5   26.43342 1.623896          ?        ? 
1 1 1   22    8   16 o 9.205216 3.642376   14.95039    14.8  0.5412986 0.9923807          ?        ? 
1 1 1   22    8   17 f 55.93911 1.747158   64.79252   262.3   31.78626 1.954689          ?        ? 
1 1 1   22    8   18 o 20.44686 3.015031   23.24226     9.9   4.420605 1.232958          ?        ? 
1 1 1   22    8   19 o 10.08149 3.968966   10.50633    81.6  0.8720922 1.172814          ?        ? 
1 1 1   22    8   20 o 26.99835 2.339088   36.35824   157.7   7.788685 1.263030          ?        ? 
1 1 1   22    9    0 o 67.36020 1.564408   122.1434   180.0   45.46908 2.105050   45.46908 2.105050 
1 1 1   22    9    1 o 90.39990 1.164299   128.6912   121.7   81.76616 2.105050          ?        ? 
1 1 1   22    9    2 o 40.13417 1.273794   65.86716   226.5   16.11867 1.022453          ?        ? 
1 1 1   22    9    3 o 66.69723 1.082101   96.09502    55.5   44.50677 1.443463          ?        ? 
1 1 1   22    9    4 o 44.36903 1.186103   51.60217   105.6   19.69725 1.052525          ?        ? 
1 1 1   22    9    5 o 86.70139 1.040542   137.9161    71.3   75.21043 1.804329          ?        ? 
1 1 1   22    9    6 o 21.99294 1.435722   19.73282   213.9   4.841615 0.6315150          ?        ? 
1 1 1   22    9    7 o 34.62978 0.9552286   40.09420    74.4   11.99879 0.6615872          ?        ? 
1 1 1   22    9    8 o 15.44228 3.489761   41.92921   191.6   2.495988 1.052525          ?        ? 
1 1 1   22    9    9 o 31.66025 1.757203   52.08825   195.9   10.04410 1.112669          ?        ? 
1 1 1   22    9   10 o 37.35525 1.690566   62.62048    90.8   13.98355 1.263030          ?        ? 
1 1 1   22    9   11 o 66.16461 1.272614   84.94750   265.4   43.84519 1.684040          ?        ? 
1 1 1   22    9   12 o 32.05966 2.298114   41.99419   222.1   10.34482 1.473535          ?        ? 
1 1 1   22    9   13 f 22.10994 3.128274   43.40250   129.5   4.961904 1.383319          ?        ? 
1 1 1   22    9   14 o 50.56150 1.605862   72.19596    37.7   25.71168 1.623896          ?        ? 
1 1 1   22    9   15 o 25.63961 2.638976   39.39412   332.5   6.706088 1.353247          ?        ? 
1 1 1   22    9   16 o 25.25586 2.738610   23.68977   182.2   6.555727 1.383319          ?        ? 
1 1 1   22    9   17 o 14.37092 4.284449   19.46921   209.2   2.315555 1.323174          ?        ? 
1 1 1   22    9   18 o 17.79927 3.826801   24.30025   114.6   3.578585 1.323174          ?        ? 
1 1 1   22    9   19 o 14.47534 3.870896   14.81695   295.1   2.465916 1.142741          ?        ? 
1 1 1   22    9   20 f 6.474584 3.101712   3.214663   212.3  -1.202886 1.142741          ?        ? 
1 1 1   22   10    0 o 51.00217 1.595421   65.25919     0.0   26.10262 1.623896   26.10262 1.623896 
1 1 1   22   10    1 o 36.11457 1.249031   67.23546   158.6   13.05131 0.9021643          ?        ? 
1 1 1   22   10    2 f 10.37033 3.330223   54.57877    88.1   1.052525 0.7818757          ?        ? 
1 1 1   22   10    3 o 171.9446 1.574050   225.9133    59.9   295.9400 5.412986          ?        ? 
1 1 1   22   10    4 o 40.32126 1.230593   38.47192   302.1   16.26903 0.9923807          ?        ? 
1 1 1   22   10    5 f 25.70600 1.579296   50.82802    40.0   6.615872 0.8119479          ?        ? 
1 1 1   22   10    6 o 20.57902 1.534366   13.10608   232.1   4.240172 0.6315150          ?        ? 
1 1 1   22   10    7 o 84.80988 0.9219159   109.8751     3.4   71.96265 1.563751          ?        ? 
1 1 1   22   10    8 o 40.79117 1.474444   59.60027    57.7   16.65997 1.202886          ?        ? 
1 1 1   22   10    9 o 66.74594 1.261530   95.09092   353.0   44.59699 1.684040          ?        ? 
1 1 1   22   10   10 f 92.25855 1.271225   89.00957   204.2   85.22446 2.345627          ?        ? 
1 1 1   22   10   11 o 13.79481 3.874331   7.590478   189.4   1.984761 1.112669          ?        ? 
1 1 1   22   10   12 o 49.65543 1.453479   71.74488   348.3   24.71930 1.443463          ?        ? 
1 1 1   22   10   13 o 36.90304 1.752027   51.77341   346.8   13.68283 1.293102          ?        ? 
1 1 1   22   10   14 o 51.37393 1.639003   60.59648   249.0   26.55371 1.684040          ?        ? 
1 1 1   22   10   15 o 16.88696 3.978519   34.44561   259.6   3.097431 1.323174          ?        ? 
1 1 1   22   10   16 o 17.92936 3.883363   25.15375    67.1   3.518441 1.353247          ?        ? 
1 1 1   22   10   17 o 31.75670 2.035952   41.12879    52.0   10.31474 1.293102          ?        ? 
1 1 1   22   10   18 o 25.07915 2.877815   35.27788   268.1   6.645944 1.443463          ?        ? 
1 1 1   22   10   19 o 14.59915 4.071308   20.50983   187.7   2.556132 1.232958          ?        ? 
1 1 1   22   11    0 f 20.29306 2.906939   48.45650   180.0   4.270245 1.142741   4.270245 1.142741 
1 1 1   22   11    1 o 88.77344 1.151756   109.7694   142.3   78.84917 2.044906          ?        ? 
1 1 1   22   11    2 o 53.88375 1.144091   68.81049    73.9   29.04969 1.232958          ?        ? 
1 1 1   22   11    3 o 114.6522 1.219650   116.1413   201.8   131.5356 2.796710          ?        ? 
1 1 1   22   11    4 o 148.9836 1.402848   189.1520   152.2   222.1730 4.180028          ?        ? 
1 1 1   22   11    5 o 41.71739 1.009195   69.01011    67.0   17.41177 0.8420200          ?        ? 
1 1 1   22   11    6 o 34.58469 1.043426   42.55474   283.0   11.96871 0.7217315          ?        ? 
1 1 1   22   11    7 o 91.00046 0.9087691   121.6085   332.1   82.84876 1.653968          ?        ? 
1 1 1   22   11    8 o 16.25643 3.521536   38.12505   136.1   2.766637 1.112669          ?        ? 
1 1 1   22   11    9 o 8.123273 3.542775   13.82426    35.5 -0.2105050 1.082597          ?        ? 
1 1 1   22   11   10 o 8.222514 3.563942   9.661492   280.2 -0.1503607 1.082597          ?        ? 
1 1 1   22   11   11 o 26.12245 2.187279   25.21067   150.6   6.856449 1.142741          ?        ? 
1 1 1   22   11   12 o 14.80409 3.670030   15.48958    28.6   2.315555 1.082597          ?        ? 
1 1 1   22   11   13 o 50.19715 1.677426   64.76315   163.3   25.32075 1.684040          ?        ? 
1 1 1   22   11   14 o 23.76953 3.036373   25.33874   232.2   5.773852 1.443463          ?        ? 
1 1 1   22   11   15 o 21.90541 3.294763   29.84428   320.3   4.961904 1.443463          ?        ? 
1 1 1   22   11   16 o 38.70972 2.019844   54.56879    84.1   15.24658 1.563751          ?        ? 
1 1 1   22   11   17 o 12.69578 4.426016   27.94926   148.1   1.714112 1.383319          ?        ? 
1 1 1   22   11   18 o 32.87041 2.287174   44.72670   161.9   11.21691 1.503607          ?        ? 
1 1 1   22   11   19 o 6.793049 3.298659   10.43930    83.4  -1.954689 1.413391          ?        ? 
1 1 1   22   12    0 o 28.62345 2.505503   17.82673    -0.0   8.390128 1.413391   8.390128 1.413391 
1 1 1   22   12    1 o 136.4828 1.355069   153.5539    19.2   186.4172 3.698874          ?        ? 
1 1 1   22   12    2 o 122.0892 1.231565   169.7372    75.4   149.1578 3.007215          ?        ? 
1 1 1   22   12    3 o 94.88996 1.125052   132.5218   119.3   90.09615 2.135122          ?        ? 
1 1 1   22   12    4 o 66.40130 1.086924   69.06326   345.3   44.11584 1.443463          ?        ? 
1 1 1   22   12    5 o 120.9768 1.118600   170.7200   237.2   146.4513 2.706493          ?        ? 
1 1 1   22   12    6 o 39.45589 1.028931   70.03668    61.2   15.57737 0.8119479          ?        ? 
1 1 1   22   12    7 o 18.17246 1.737561   14.47694    49.1   3.307936 0.6315150          ?        ? 
1 1 1   22   12    8 o 105.4079 1.326613   132.5235   249.9   111.2369 2.796710          ?        ? 
1 1 1   22   12    9 o 37.55145 1.801857   41.67926   264.9   14.13391 1.353247          ?        ? 
1 1 1   22   12   10 o 46.83259 1.573194   59.53299    43.7   21.98274 1.473535          ?        ? 
1 1 1   22   12   11 o 19.53041 2.848556   26.87611   100.3   3.849235 1.112669          ?        ? 
1 1 1   22   12   12 o 34.95415 1.720662   50.76194   150.8   12.26943 1.202886          ?        ? 
1 1 1   22   12   13 o 39.48928 1.789588   45.42149    28.8   15.69766 1.413391          ?        ? 
1 1 1   22   12   14 o 36.58653 2.054865   45.31684    11.6   13.53246 1.503607          ?        ? 
1 1 1   22   12   15 o 38.21540 1.967279   51.44705    37.4   14.79550 1.503607          ?        ? 
1 1 1   22   12   16 o 23.41580 2.953815   25.44882   329.9   5.713707 1.383319          ?        ? 
1 1 1   22   12   17 o 12.74023 4.019475   9.750812   164.0   1.804329 1.142741          ?        ? 
1 1 1   22   12   18 o 16.69889 4.297700   16.87555   119.5   3.307936 1.443463          ?        ? 
1 1 1   22   12   19 o 17.96645 4.315778   23.79294   255.6   4.029667 1.533679          ?        ? 
1 1 1   22   13    0 o 85.85117 1.612568   95.94210     0.0   73.82712 2.766637   73.82712 2.766637 
1 1 1   22   13    1 o 74.76891 1.065833   125.3954    17.2   55.93419 1.593824          ?        ? 
1 1 1   22   13    2 o 134.4140 1.319994   175.3480    51.2   180.8238 3.548513          ?        ? 
1 1 1   22   13    3 o 62.57989 1.081215   86.91064   145.7   39.18401 1.353247          ?        ? 
1 1 1   22   13    4 o 47.06467 1.054274   44.26954   271.0   22.16317 0.9923807          ?        ? 
1 1 1   22   13    5 o 106.5787 1.100420   130.2729   327.7   113.6727 2.345627          ?        ? 
1 1 1   22   13    6 o 100.4752 1.032583   119.3908   339.7   101.0123 2.074978          ?        ? 
1 1 1   22   13    7 o 63.70148 0.8733466   109.2292   184.9   40.59740 1.112669          ?        ? 
1 1 1   22   13    8 o 70.46566 0.8748644   81.06611   236.3   49.67918 1.232958          ?        ? 
1 1 1   22   13    9 f 19.99653 3.158122   52.50666   308.5   4.029667 1.263030          ?        ? 
1 1 1   22   13   10 o 34.79239 1.944745   41.46688   263.9   12.14915 1.353247          ?        ? 
1 1 1   22   13   11 o 57.16078 1.367853   65.33582   123.9   32.74857 1.563751          ?        ? 
1 1 1   22   13   12 o 18.78382 3.041825   26.07673   311.5   3.578585 1.142741          ?        ? 
1 1 1   22   13   13 o 32.18533 2.148990   50.82769    24.7   10.46511 1.383319          ?        ? 
1 1 1   22   13   14 o 66.76649 1.441305   87.43584    66.2   44.83757 1.924617          ?        ? 
1 1 1   22   13   15 o 24.29224 2.847244   32.34893   140.4   6.074574 1.383319          ?        ? 
1 1 1   22   13   16 f 10.14677 4.244477   11.28561   246.2  0.4210100 1.443463          ?        ? 
1 1 1   22   13   17 o 9.086308 4.004108   15.66243   348.1 -0.1202886 1.413391          ?        ? 
1 1 1   22   13   18 o 19.56985 3.979964   29.59519     7.1   4.450677 1.503607          ?        ? 
1 1 1   22   13   19 f 14.71280 4.658047   25.89048   304.6   2.826782 1.533679          ?        ? 
1 1 1   22   14    0 o 74.82311 1.730269   78.98598    -0.0   56.11462 2.586205   56.11462 2.586205 
1 1 1   22   14    1 o 94.22104 1.164956   140.4073    43.0   88.83311 2.195267          ?        ? 
1 1 1   22   14    2 o 50.68822 1.245881   59.93299    27.1   25.71168 1.263030          ?        ? 
1 1 1   22   14    3 o 13.98079 3.368800   38.07496   159.2   2.044906 0.9322364          ?        ? 
1 1 1   22   14    4 o 7.536399 3.136326   33.91005   135.5  0.1202886 0.7818757          ?        ? 
1 1 1   22   14    5 o 6.471059 2.826892   15.89599    86.8 -0.1503607 0.6916593          ?        ? 
1 1 1   22   14    6 o 14.99372 2.406779   35.54792   197.3   2.255411 0.7217315          ?        ? 
1 1 1   22   14    7 o 78.14797 0.9427853   97.97740    59.7   61.10660 1.473535          ?        ? 
1 1 1   22   14    8 o 32.89030 1.051464   27.74349   326.8   10.82597 0.6916593          ?        ? 
1 1 1   22   14    9 o 81.93961 1.321214   116.4727   144.9   67.24132 2.165194          ?        ? 
1 1 1   22   14   10 o 38.09162 1.776305   46.20222   103.0   14.55492 1.353247          ?        ? 
1 1 1   22   14   11 o 33.60305 1.834592   37.09252   309.8   11.33720 1.232958          ?        ? 
1 1 1   22   14   12 o 21.03490 2.859262   26.04965    12.9   4.480750 1.202886          ?        ? 
1 1 1   22   14   13 f 18.10838 2.823148   14.13108    22.5   3.338008 1.022453          ?        ? 
1 1 1   22   14   14 o 36.23201 2.074971   54.87363    99.7   13.29189 1.503607          ?        ? 
1 1 1   22   14   15 o 18.65507 4.062446   23.33521   138.5   3.819162 1.473535          ?        ? 
1 1 1   22   14   16 f 55.48858 1.571661   68.43682   178.8   31.18481 1.744184          ?        ? 
1 1 1   22   14   17 o 22.00820 3.279376   37.91131   313.3   5.172409 1.443463          ?        ? 
1 1 1   22   14   18 o 14.23081 4.409112   18.05087   268.6   2.435844 1.383319          ?        ? 
1 1 1   22   14   19 o 15.08444 4.690731   15.64066   265.7   3.007215 1.563751          ?        ? 
1 1 1   22   15    0 o 90.33885 1.582272   86.07866    -0.0   81.73608 2.856854   81.73608 2.856854 
1 1 1   22   15    1 o 37.09120 1.499910   50.55201   293.7   13.77304 1.112669          ?        ? 
1 1 1   22   15    2 o 96.20290 1.203475   123.5731   138.3   92.62221 2.315555          ?        ? 
1 1 1   22   15    3 o 33.47475 1.302612   46.98464     7.7   11.21691 0.8720922          ?        ? 
1 1 1   22   15    4 o 29.05039 1.500999   24.99744   120.0   8.450273 0.8720922          ?        ? 
1 1 1   22   15    5 o 22.85338 1.842222   15.41824    13.2   5.232553 0.8420200          ?        ? 
1 1 1   22   15    6 o 46.06246 1.011926   37.93742   166.5   21.23093 0.9322364          ?        ? 
1 1 1   22   15    7 o 48.29051 1.027511   77.27952   160.3   23.33598 0.9923807          ?        ? 
1 1 1   22   15    8 o 58.45496 0.9260097   83.57594    28.0   34.19203 1.082597          ?        ? 
1 1 1   22   15    9 o 19.29057 1.480959   26.50476   111.9   3.728946 0.5713707          ?        ? 
1 1 1   22   15   10 o 7.334117 3.406877   6.576525   278.8  -1.052525 1.202886          ?        ? 
1 1 1   22   15   11 o 29.68388 2.228776   38.30991   339.2   8.871283 1.323174          ?        ? 
1 1 1   22   15   12 o 38.78636 1.705721   47.91397    52.0   15.12629 1.323174          ?        ? 
1 1 1   22   15   13 o 16.82959 3.758921   21.99932    75.5   3.037287 1.232958          ?        ? 
1 1 1   22   15   14 o 14.50064 4.449529   21.37650   253.8   2.255411 1.413391          ?        ? 
1 1 1   22   15   15 o 37.41711 2.129806   46.55343   157.9   14.25420 1.593824          ?        ? 
1 1 1   22   15   16 o 19.87365 3.253309   26.62201   229.9   4.180028 1.293102          ?        ? 
1 1 1   22   15   17 o 11.73031 4.422147   20.56183   320.4   1.323174 1.413391          ?        ? 
1 1 1   22   15   18 o 9.305198 3.960214   11.82579    46.7  0.3608657 1.293102          ?        ? 
1 1 1   22   15   19 o 13.31716 4.658659   6.447143    53.6   2.315555 1.533679          ?        ? 
1 1 1   22   16    0 o 44.73040 1.753831   106.4790   360.0   20.11827 1.563751   20.11827 1.563751 
1 1 1   22   16    1 o 46.18519 1.269686   63.88354   278.0   21.35122 1.172814          ?        ? 
1 1 1   22   16    2 o 99.74808 1.100406   125.4806   336.8   99.56887 2.195267          ?        ? 
1 1 1   22   16    3 o 47.02898 1.119018   77.43575   151.5   22.13310 1.052525          ?        ? 
1 1 1   22   16    4 o 37.69795 1.276341   47.93640   191.7   14.22412 0.9623086          ?        ? 
1 1 1   22   16    5 o 64.60979 1.023974   102.5109   120.3   41.77021 1.323174          ?        ? 
1 1 1   22   16    6 o 71.51910 0.9881212   63.80051   295.2   51.18279 1.413391          ?        ? 
1 1 1   22   16    7 o 38.21109 1.180501   35.37933   177.1   14.61506 0.9021643          ?        ? 
1 1 1   22   16    8 o 16.32892 2.117897   38.49738    15.5   2.676421 0.6916593          ?        ? 
1 1 1   22   16    9 o 18.57048 1.700320   19.87186    68.6   3.458297 0.6315150          ?        ? 
1 1 1   22   16   10 o 33.05706 1.910379   29.81433   235.0   10.97633 1.263030          ?        ? 
1 1 1   22   16   11 o 25.72451 2.396466   48.57803    29.8   6.676016 1.232958          ?        ? 
1 1 1   22   16   12 o 28.87996 2.082561   38.05233    22.8   8.420200 1.202886          ?        ? 
1 1 1   22   16   13 o 31.96426 1.881610   39.39371   154.4   10.31474 1.202886          ?        ? 
1 1 1   22   16   14 o 31.68294 2.135608   43.82243   296.0   10.19446 1.353247          ?        ? 
1 1 1   22   16   15 o 14.39713 4.617671   26.15547   207.2   2.285483 1.503607          ?        ? 
1 1 1   22   16   16 o 26.17858 3.044137   34.10072   319.0   7.247387 1.593824          ?        ? 
1 1 1   22   16   17 o 17.59802 4.302257   16.50706   285.3   3.638730 1.503607          ?        ? 
1 1 1   22   16   18 o 24.44732 2.829183   29.68027   138.5   6.465511 1.383319          ?        ? 
1 1 1   22   17    0 f 90.15763 1.685747   86.64352   180.0   81.43536 3.037287   81.43536 3.037287 
1 1 1   22   17    1 o 12.56260 3.627495   44.34698   204.6   1.623896 0.9623086          ?        ? 
1 1 1   22   17    2 o 31.09848 1.498846   40.78799   250.6   9.683230 0.9322364          ?        ? 
1 1 1   22   17    3 o 108.6163 1.162837   161.2401   114.3   118.0632 2.526060          ?        ? 
1 1 1   22   17    4 o 7.325132 3.158588   43.67212     1.9      -0.09 0.8420200          ?        ? 
1 1 1   22   17    5 o 88.88443 1.031902   130.3410   159.5   79.05967 1.834401          ?        ? 
1 1 1   22   17    6 f 60.42531 1.020233   61.92133   329.5   36.53765 1.232958          ?        ? 
1 1 1   22   17    7 o 96.44921 1.044505   123.6489   357.3   93.10336 2.014834          ?        ? 
1 1 1   22   17    8 o 23.99888 1.628984   48.26067   111.9   5.773852 0.7818757          ?        ? 
1 1 1   22   17    9 o 43.63896 1.033668   52.95102   218.4   19.06574 0.9021643          ?        ? 
1 1 1   22   17   10 o 37.41124 1.004783   41.86654   280.2   14.01362 0.7518036          ?        ? 
1 1 1   22   17   11 o 40.87465 1.655362   70.93037    52.6   16.78026 1.353247          ?        ? 
1 1 1   22   17   12 o 39.74395 1.778121   55.74701   114.8   15.90816 1.413391          ?        ? 
1 1 1   22   17   13 o 22.24416 2.703824   20.90809   150.9   5.052120 1.202886          ?        ? 
1 1 1   22   17   14 o 11.10479 4.424361   17.35222   142.8  0.8119479 1.473535          ?        ? 
1 1 1   22   17   15 o 7.589009 3.571883   14.47526   278.2  -1.353247 1.413391          ?        ? 
1 1 1   22   17   16 o 16.42304 4.397347   13.47848   258.9   3.127503 1.473535          ?        ? 
1 1 1   22   17   17 o 10.84780 4.410458   22.44032    84.0  0.9021643 1.503607          ?        ? 
1 1 1   22   17   18 o 13.89561 4.576379   17.68396   292.1   2.465916 1.473535          ?        ? 
1 1 1   22   18    0 o 6.017245 4.053530   13.12358     0.0 -0.4811543 1.353247 -0.4811543 1.353247 
1 1 1   22   18    1 o 65.46558 1.033556   83.47997   139.1   42.88288 1.353247          ?        ? 
1 1 1   22   18    2 o 57.85985 1.091456   69.05377    44.5   33.50037 1.263030          ?        ? 
1 1 1   22   18    3 o 43.78252 1.201992   20.02251    37.6   19.18603 1.052525          ?        ? 
1 1 1   22   18    4 o 65.11555 1.062203   74.28337    98.6   42.43180 1.383319          ?        ? 
1 1 1   22   18    5 o 29.70991 1.568898   28.98060   226.1   8.841210 0.9322364          ?        ? 
1 1 1   22   18    6 o 39.13890 1.267768   51.13172   266.5   15.33679 0.9923807          ?        ? 
1 1 1   22   18    7 o 45.22846 1.130320   66.36946   352.8   20.47913 1.022453          ?        ? 
1 1 1   22   18    8 o 78.68577 1.031887   121.4908   211.1   61.97869 1.623896          ?        ? 
1 1 1   22   18    9 o 80.88404 0.9666626   103.7300   209.1   65.49713 1.563751          ?        ? 
1 1 1   22   18   10 o 43.83965 0.9603407   62.41785   284.3   19.24617 0.8420200          ?        ? 
1 1 1   22   18   11 o 9.735413 3.981884   22.77057   157.6  0.3909379 1.232958          ?        ? 
1 1 1   22   18   12 o 82.69196 1.418292   91.86160   180.1   68.71485 2.345627          ?        ? 
1 1 1   22   18   13 o 33.38998 1.936363   42.76063   116.4   11.27705 1.293102          ?        ? 
1 1 1   22   18   14 o 34.38758 2.273716   44.97630   142.7   12.05893 1.563751          ?        ? 
1 1 1   22   18   15 o 9.207011 4.068804   13.44378   130.5 -0.2105050 1.473535          ?        ? 
1 1 1   22   18   16 o 7.918434 3.716201   3.032617   302.8  -1.263030 1.503607          ?        ? 
1 1 1   22   18   17 f 20.23692 3.929541   23.07304   118.7   4.751399 1.533679          ?        ? 
1 1 1   22   18   18 o 13.86365 4.668842   7.422987    12.0   2.495988 1.533679          ?        ? 
1 1 1   22   19    0 o 10.18958 4.776666   12.22928   180.0   1.533679 1.082597   1.533679 1.082597 
1 1 1   22   19    1 o 44.12296 1.226796   53.68840    73.3   19.48675 1.082597          ?        ? 
1 1 1   22   19    2 o 27.98721 1.772918   54.58539    80.8   7.848830 0.9923807          ?        ? 
1 1 1   22   19    3 o 123.0383 1.222064   136.8013    78.0   151.5335 3.007215          ?        ? 
1 1 1   22   19    4 o 90.98843 1.041091   106.7071    25.5   82.84876 1.894545          ?        ? 
1 1 1   22   19    5 o 44.21890 1.292141   61.98748   273.6   19.57697 1.142741          ?        ? 
1 1 1   22   19    6 o 85.21886 1.005712   110.0295   319.6   72.68437 1.714112          ?        ? 
1 1 1   22   19    7 o 37.15918 1.375774   40.72958   266.4   13.83319 1.022453          ?        ? 
1 1 1   22   19    8 o 64.47649 1.002770   64.80323    16.9   41.61985 1.293102          ?        ? 
1 1 1   22   19    9 o 46.30214 1.104110   55.21242   337.6   21.47151 1.022453          ?        ? 
1 1 1   22   19   10 o 24.36011 1.481380   15.02345   217.8   5.954284 0.7217315          ?        ? 
1 1 1   22   19   11 o 18.78917 1.520479   32.76353   220.4   3.548513 0.5713707          ?        ? 
1 1 1   22   19   12 o 21.47166 2.941156   29.20875   347.5   4.721327 1.263030          ?        ? 
1 1 1   22   19   13 o 20.65351 2.912062   43.14025   262.2   4.390533 1.202886          ?        ? 
1 1 1   22   19   14 o 32.35991 2.462652   46.73213   233.5   10.76583 1.593824          ?        ? 
1 1 1   22   19   15 o 12.15367 4.565310   21.82160    78.9   1.413391 1.503607          ?        ? 
1 1 1   22   19   16 o 26.40846 2.960702   15.52876    60.6   7.397748 1.563751          ?        ? 
1 1 1   22   19   17 o 20.11425 4.176137   19.55176   152.3   4.811543 1.623896          ?        ? 
1 1 1   22   19   18 o 12.18115 4.602247   12.71569   136.3   1.804329 1.533679          ?        ? 
1 1 1   22   20    0 o 51.96799 1.507332   44.39712   180.0   27.09500 1.563751   27.09500 1.563751 
1 1 1   22   20    1 o 66.21352 1.067298   50.14618   267.1   43.87526 1.413391          ?        ? 
1 1 1   22   20    2 o 54.23603 1.136659   58.34904    96.4   29.44063 1.232958          ?        ? 
1 1 1   22   20    3 o 35.76995 1.345136   50.76924   189.2   12.81073 0.9623086          ?        ? 
1 1 1   22   20    4 o 55.96717 1.343294   76.10868   200.3   31.36525 1.503607          ?        ? 
1 1 1   22   20    5 o 57.10622 1.316500   59.68693   255.8   32.65835 1.503607          ?        ? 
1 1 1   22   20    6 o 23.19538 2.528120   27.71651    38.0   5.412986 1.172814          ?        ? 
1 1 1   22   20    7 o 14.82335 3.748685   16.06003   293.0   2.315555 1.112669          ?        ? 
1 1 1   22   20    8 o 33.57054 1.657211   41.90363   155.7   11.30713 1.112669          ?        ? 
1 1 1   22   20    9 o 23.42163 2.375303   13.60958    54.1   5.533275 1.112669          ?        ? 
1 1 1   22   20   10 o 59.00593 1.172186   58.46471   359.2   34.91376 1.383319          ?        ? 
1 1 1   22   20   11 o 31.06861 1.161512   40.72412   308.2   9.683230 0.7217315          ?        ? 
1 1 1   22   20   12 o 43.52670 1.036335   53.04300   292.0   19.00560 0.9021643          ?        ? 
1 1 1   22   20   13 o 9.434651 3.933144   15.11671   245.8  0.3007214 1.232958          ?        ? 
1 1 1   22   20   14 o 11.14896 4.184913   11.80413   153.8   1.112669 1.263030          ?        ? 
1 1 1   22   20   15 o 24.69554 3.105175   36.91856   106.3   6.465511 1.533679          ?        ? 
1 1 1   22   20   16 o 11.35482 4.486452   14.94752   137.2   1.142741 1.503607          ?        ? 
1 1 1   22   20   17 o 7.502500 3.585430   3.833956    14.4  -1.443463 1.503607          ?        ? 
1 1 1   22   21    0 o 11.04763 5.160433   6.241899     0.0   1.804329 1.263030   1.804329 1.263030 
1 1 1   22   21    1 o 95.09579 1.154240   100.7752   231.6   90.51716 2.195267          ?        ? 
1 1 1   22   21    2 o 51.60676 1.456793   68.73389     5.1   26.67399 1.503607          ?        ? 
1 1 1   22   21    3 o 17.65914 3.356727   33.20984   233.7   3.247792 1.142741          ?        ? 
1 1 1   22   21    4 o 30.97362 1.893246   28.46732   155.8   9.623086 1.172814          ?        ? 
1 1 1   22   21    5 o 45.99709 1.471013   39.41689   213.4   21.20086 1.353247          ?        ? 
1 1 1   22   21    6 o 8.672646 3.733549   17.11682   184.0      -0.09 1.172814          ?        ? 
1 1 1   22   21    7 o 39.21783 1.571936   41.70525   146.3   15.42701 1.232958          ?        ? 
1 1 1   22   21    8 o 39.32525 1.567642   53.67898   102.8   15.51723 1.232958          ?        ? 
1 1 1   22   21    9 o 55.87938 1.264680   79.41478   313.0   31.30510 1.413391          ?        ? 
1 1 1   22   21   10 o 6.859068 3.203860   2.504349    87.2 -0.9923807 1.082597          ?        ? 
1 1 1   22   21   11 o 31.67456 1.613997   35.86638    76.6   10.10424 1.022453          ?        ? 
1 1 1   22   21   12 f 30.95427 1.505829   38.61933   198.6   9.653158 0.9322364          ?        ? 
1 1 1   22   21   13 o 29.05997 2.121403   31.59668   339.2   8.600634 1.232958          ?        ? 
1 1 1   22   21   14 o 34.35976 1.750428   40.96101    44.6   11.99879 1.202886          ?        ? 
1 1 1   22   21   15 o 14.54348 4.559622   30.78058   279.5   2.435844 1.473535          ?        ? 
1 1 1   22   21   16 o 15.27709 4.624485   10.63758    85.9   2.856854 1.533679          ?        ? 
1 1 1   22   21   17 o 22.59786 3.459955   25.10710   294.3   5.833996 1.563751          ?        ? 
1 1 1   22   22    0 o 19.67187 5.231717   75.68813   180.0   4.631110 1.774257   4.631110 1.774257 
1 1 1   22   22    1 o 88.55515 1.239491   81.46277    41.0   78.51837 2.195267          ?        ? 
1 1 1   22   22    2 o 37.91870 1.467178   39.59905   274.6   14.40456 1.112669          ?        ? 
1 1 1   22   22    3 o 62.96004 1.241860   50.55641     8.5   39.69523 1.563751          ?        ? 
1 1 1   22   22    4 o 26.46476 2.215803   42.18863    97.3   7.036882 1.172814          ?        ? 
1 1 1   22   22    5 o 73.94935 1.179310   72.47549   126.5   54.76138 1.744184          ?        ? 
1 1 1   22   22    6 o 63.46115 1.303134   68.79447    99.3   40.35682 1.653968          ?        ? 
1 1 1   22   22    7 o 8.110442 3.563899   22.14227     0.8 -0.2706493 1.112669          ?        ? 
1 1 1   22   22    8 f 39.08436 1.615774   50.75636   319.8   15.33679 1.263030          ?        ? 
1 1 1   22   22    9 o 20.05781 2.773656   34.59457    35.5   4.089812 1.112669          ?        ? 
1 1 1   22   22   10 o 11.31162 3.867746   31.43679    39.4   1.232958 1.052525          ?        ? 
1 1 1   22   22   11 o 26.86425 2.070911   33.49516   310.5   7.307531 1.112669          ?        ? 
1 1 1   22   22   12 o 40.41780 1.376460   61.87121   227.5   16.44946 1.112669          ?        ? 
1 1 1   22   22   13 o 57.94899 1.063830   71.80904   273.2   33.77102 1.232958          ?        ? 
1 1 1   22   22   14 o 8.085104 3.672986   4.704303   133.0 -0.5412986 1.293102          ?        ? 
1 1 1   22   22   15 o 8.652849 3.949568   11.79051   257.0 -0.6615872 1.533679          ?        ? 
1 1 1   22   22   16 o 16.29891 4.539251   9.143089   192.0   3.277864 1.533679          ?        ? 
1 1 1   22   22   17 o 13.67239 4.433514   19.41086   226.4   2.405771 1.383319          ?        ? 
1 1 1   22   23    0 o 43.32486 2.127965   52.80043     0.0   18.94545 1.834401   18.94545 1.834401 
1 1 1   22   23    1 o 28.10268 2.354178   31.15740   235.2   7.939046 1.323174          ?        ? 
1 1 1   22   23    2 o 51.36269 1.434441   64.05074   274.9   26.43342 1.473535          ?        ? 
1 1 1   22   23    3 o 76.48453 1.199197   81.74925   325.9   58.58054 1.834401          ?        ? 
1 1 1   22   23    4 o 77.81875 1.236603   88.00204   165.9   60.65551 1.924617          ?        ? 
1 1 1   22   23    5 o 24.91663 2.474167   36.96348   280.1   6.255006 1.232958          ?        ? 
1 1 1   22   23    6 f 76.75967 1.234076   82.37357   201.7   59.03162 1.894545          ?        ? 
1 1 1   22   23    7 o 26.24536 2.348907   42.87955    81.5   6.946666 1.232958          ?        ? 
1 1 1   22   23    8 o 24.83027 2.240550   45.83892   304.8   6.224934 1.112669          ?        ? 
1 1 1   22   23    9 o 26.39518 2.107713   33.14447    68.2   7.036882 1.112669          ?        ? 
1 1 1   22   23   10 o 20.56023 2.486482   37.47644   133.0   4.300317 1.022453          ?        ? 
1 1 1   22   23   11 o 11.54853 3.812092   22.86748   150.8   1.353247 1.022453          ?        ? 
1 1 1   22   23   12 o 33.62219 1.654665   34.77851   192.2   11.42741 1.112669          ?        ? 
1 1 1   22   23   13 o 51.44521 1.227549   60.47693   344.6   26.67399 1.263030          ?        ? 
1 1 1   22   23   14 o 25.34475 1.601807   21.58921     4.0   6.525656 0.8119479          ?        ? 
1 1 1   22   23   15 o 11.91192 4.676389   10.22823   123.2   1.353247 1.623896          ?        ? 
1 1 1   22   23   16 o 10.97709 4.541013   13.33804   181.1   1.022453 1.623896          ?        ? 
1 1 1   22   24    0 o 56.17463 1.932206   81.62359     0.0   31.72611 2.165194   31.72611 2.165194 
1 1 1   22   24    1 o 71.08002 1.311531   67.40195    83.3   50.61142 1.864473          ?        ? 
1 1 1   22   24    2 o 33.82736 1.911326   21.46703   112.1   11.48756 1.293102          ?        ? 
1 1 1   22   24    3 o 40.11783 1.686590   38.77521    73.8   16.14874 1.353247          ?        ? 
1 1 1   22   24    4 f 29.04171 2.122736   13.81494   261.4   8.480345 1.232958          ?        ? 
1 1 1   22   24    5 o 49.07568 1.440011   39.11389    91.9   24.14793 1.413391          ?        ? 
1 1 1   22   24    6 o 34.45467 1.920167   54.13980   322.0   11.93864 1.323174          ?        ? 
1 1 1   22   24    7 o 27.75002 2.058992   29.80135   250.7   7.758613 1.142741          ?        ? 
1 1 1   22   24    8 o 56.37430 1.333593   72.28131   292.2   31.90655 1.503607          ?        ? 
1 1 1   22   24    9 o 32.63665 1.750703   41.76766    19.0   10.73576 1.142741          ?        ? 
1 1 1   22   24   10 o 16.85385 3.420089   30.24048   330.9   3.037287 1.112669          ?        ? 
1 1 1   22   24   11 o 14.93118 3.812817   25.79259   158.1   2.435844 1.142741          ?        ? 
1 1 1   22   24   12 f 29.45973 1.939498   41.26444   277.2   8.841210 1.142741          ?        ? 
1 1 1   22   24   13 o 26.16925 1.953539   26.69496   212.2   7.006810 1.022453          ?        ? 
1 1 1   22   24   14 o 32.52703 1.479245   33.94416   101.7   10.73576 0.9623086          ?        ? 
1 1 1   22   24   15 o 6.238185 2.879549   16.72387   335.9 -0.5412986 0.8420200          ?        ? 
1 1 1   22   24   16 o 12.81705 4.722188   12.85776   309.5   2.044906 1.593824          ?        ? 
1 1 1   22   25    0 o 42.21865 2.475135   68.24843     0.0   18.07336 2.074978   18.07336 2.074978 
1 1 1   22   25    1 f 44.54045 1.687912   74.80970    47.4   19.90776 1.503607          ?        ? 
1 1 1   22   25    2 o 71.70217 1.279181   86.19874   240.1   51.51358 1.834401          ?        ? 
1 1 1   22   25    3 o 44.01263 1.537339   53.16264   260.7   19.42661 1.353247          ?        ? 
1 1 1   22   25    4 o 37.43267 1.767406   50.60733    54.0   14.07376 1.323174          ?        ? 
1 1 1   22   25    5 o 39.91778 1.619707   43.98667    38.0   15.99838 1.293102          ?        ? 
1 1 1   22   25    6 o 43.88867 1.473162   60.25233    37.7   19.33639 1.293102          ?        ? 
1 1 1   22   25    7 o 31.71415 1.849039   30.46323   252.2   10.13431 1.172814          ?        ? 
1 1 1   22   25    8 o 35.24489 1.706468   43.50322   319.9   12.51001 1.202886          ?        ? 
1 1 1   22   25    9 o 14.65005 3.693379   16.61115   235.1   2.315555 1.082597          ?        ? 
1 1 1   22   25   10 o 28.55831 2.000716   21.02518   259.4   8.269840 1.142741          ?        ? 
1 1 1   22   25   11 o 35.25039 1.834168   41.76864   146.1   12.60023 1.293102          ?        ? 
1 1 1   22   25   12 o 12.64889 3.961464   11.20127   299.2   1.744184 1.112669          ?        ? 
1 1 1   22   25   13 o 30.33348 1.784492   35.86261    23.4   9.382509 1.082597          ?        ? 
1 1 1   22   25   14 o 19.08731 2.678358   15.27064   317.0   3.849235 1.022453          ?        ? 
1 1 1   22   25   15 o 8.054808 3.449919   12.97152   227.8  0.1804329 0.9923807          ?        ? 
1 1 1   22   25   16 o 19.43932 2.397811   19.68148   261.9   4.059740 0.9322364          ?        ? 
1 1 1   22   26    0 o 104.5658 1.885088   85.62891   180.0   109.7032 3.939451   109.7032 3.939451 
1 1 1   22   26    1 o 61.74857 1.339276   81.82770   205.0   38.22169 1.653968          ?        ? 
1 1 1   22   26    2 o 47.12461 1.531538   33.41365   219.2   22.28346 1.443463          ?        ? 
1 1 1   22   26    3 o 13.55245 4.155262   34.06651    20.0   1.894545 1.232958          ?        ? 
1 1 1   22   26    4 o 33.03325 1.957274   44.42222    55.0   10.97633 1.293102          ?        ? 
1 1 1   22   26    5 o 12.36768 4.134791   19.41134   181.1   1.503607 1.202886          ?        ? 
1 1 1   22   26    6 o 36.89317 1.834007   58.99786   352.1   13.71290 1.353247          ?        ? 
1 1 1   22   26    7 o 10.99783 4.003685   12.88999   203.8   1.052525 1.142741          ?        ? 
1 1 1   22   26    8 o 28.10009 2.140359   16.61092   150.1   7.999191 1.202886          ?        ? 
1 1 1   22   26    9 o 10.53655 4.011704   17.53715   167.9  0.8720922 1.172814          ?        ? 
1 1 1   22   26   10 o 33.82708 1.777993   26.73199    58.7   11.57778 1.202886          ?        ? 
1 1 1   22   26   11 o 29.37088 2.047752   25.24403   204.5   8.811138 1.202886          ?        ? 
1 1 1   22   26   12 f 13.02107 4.001987   29.40234   209.1   1.894545 1.142741          ?        ? 
1 1 1   22   26   13 o 35.06839 1.715057   36.72977   261.4   12.54008 1.202886          ?        ? 
1 1 1   22   26   14 f 11.32088 3.867747   11.44536    73.5   1.413391 1.052525          ?        ? 
1 1 1   22   26   15 o 23.29684 2.323485   25.31807   153.1   5.773852 1.082597          ?        ? 
1 1 1   22   27    0 o 26.44521 3.400651   33.66886   360.0   7.157170 1.804329   7.157170 1.804329 
1 1 1   22   27    1 o 33.79876 1.912944   53.62720   217.2   11.48756 1.293102          ?        ? 
1 1 1   22   27    2 o 58.41034 1.390076   93.67417    43.5   34.22210 1.623896          ?        ? 
1 1 1   22   27    3 o 39.55825 1.672438   54.82990   157.3   15.72773 1.323174          ?        ? 
1 1 1   22   27    4 o 16.76958 3.768305   16.99795    92.1   3.007215 1.232958          ?        ? 
1 1 1   22   27    5 o 25.38669 2.369127   33.83249   156.3   6.525656 1.202886          ?        ? 
1 1 1   22   27    6 o 23.40975 2.504968   22.84604   122.9   5.563347 1.172814          ?        ? 
1 1 1   22   27    7 o 26.42722 2.389639   38.91710   238.0   7.097026 1.263030          ?        ? 
1 1 1   22   27    8 o 25.90812 2.611626   29.69828   250.3   6.856449 1.353247          ?        ? 
1 1 1   22   27    9 o 8.562848 3.685817   10.82810    11.8   0.000000 1.142741          ?        ? 
1 1 1   22   27   10 o 10.79604 3.994812   17.37219    27.1   1.052525 1.142741          ?        ? 
1 1 1   22   27   11 o 7.135484 3.316920   16.83116    40.1 -0.8720922 1.142741          ?        ? 
1 1 1   22   27   12 o 10.10861 3.814528   7.720753   359.0  0.9021643 1.052525          ?        ? 
1 1 1   22   27   13 o 7.703902 3.499322   2.477019    53.2 -0.4510822 1.172814          ?        ? 
1 1 1   22   27   14 o 10.27530 3.782546   21.62792   342.3   1.082597 1.022453          ?        ? 
1 1 1   22   27   15 o 10.62961 3.744592   14.06229   141.4   1.293102 0.9923807          ?        ? 
1 1 1   22   28    0 o 61.34816 1.915845   80.45490    -0.0   37.89090 2.345627   37.89090 2.345627 
1 1 1   22   28    1 o 34.02096 1.944646   33.50291   192.3   11.66799 1.323174          ?        ? 
1 1 1   22   28    2 o 9.973585 4.018131   12.66733   345.2  0.5112265 1.232958          ?        ? 
1 1 1   22   28    3 o 69.34292 1.301019   60.34511    50.6   48.26579 1.804329          ?        ? 
1 1 1   22   28    4 o 57.19954 1.419501   67.18946   344.6   32.86885 1.623896          ?        ? 
1 1 1   22   28    5 o 7.384156 3.421172   7.564406    39.0 -0.9623086 1.202886          ?        ? 
1 1 1   22   28    6 o 28.33746 2.281613   39.46523   103.5   8.149551 1.293102          ?        ? 
1 1 1   22   28    7 o 37.65260 1.757083   50.12315   134.2   14.31434 1.323174          ?        ? 
1 1 1   22   28    8 o 38.31730 1.451915   53.02826    88.9   14.79550 1.112669          ?        ? 
1 1 1   22   28    9 o 13.58178 4.092355   15.83120   133.0   2.014834 1.202886          ?        ? 
1 1 1   22   28   10 o 25.35351 2.372227   27.36974    37.6   6.615872 1.202886          ?        ? 
1 1 1   22   28   11 o 28.01952 2.200177   34.42955    57.4   8.089407 1.232958          ?        ? 
1 1 1   22   28   12 o 23.88995 2.643434   36.87400    53.6   5.984357 1.263030          ?        ? 
1 1 1   22   28   13 o 33.16758 1.858680   40.00453    57.3   11.33720 1.232958          ?        ? 
1 1 1   22   28   14 o 9.349377 3.862868   4.432760    35.0  0.6315150 1.172814          ?        ? 
1 1 1   22   29    0 o 9.219948 5.386914   15.29130   180.0   1.112669 1.623896   1.112669 1.623896 
1 1 1   22   29    1 o 21.37701 2.954178   32.58724    18.5   4.661182 1.263030          ?        ? 
1 1 1   22   29    2 o 55.62324 1.459728   76.80930   309.2   31.09460 1.623896          ?        ? 
1 1 1   22   29    3 o 55.35881 1.385217   61.69209   276.0   30.79388 1.533679          ?        ? 
1 1 1   22   29    4 f 45.82204 1.575075   58.60766    59.3   21.14072 1.443463          ?        ? 
1 1 1   22   29    5 o 16.47798 3.965774   20.03613   206.6   2.947070 1.293102          ?        ? 
1 1 1   22   29    6 o 27.67766 2.281678   41.03557   198.7   7.788685 1.263030          ?        ? 
1 1 1   22   29    7 o 55.26602 1.496370   54.93744   225.6   30.79388 1.653968          ?        ? 
1 1 1   22   29    8 o 11.72878 4.029096   10.79477   236.3   1.383319 1.142741          ?        ? 
1 1 1   22   29    9 o 44.15726 1.293945   46.28505   204.1   19.66718 1.142741          ?        ? 
1 1 1   22   29   10 o 15.67221 4.012282   16.89844   169.9   2.796710 1.263030          ?        ? 
1 1 1   22   29   11 o 10.41298 3.997975   18.31063    76.9  0.9322364 1.172814          ?        ? 
1 1 1   22   29   12 o 15.41202 4.046037   19.33286    64.4   2.796710 1.263030          ?        ? 
1 1 1   22   29   13 o 19.12502 3.426056   17.05724   114.3   4.180028 1.263030          ?        ? 
1 1 1   22   29   14 o 13.22459 4.114377   16.34485    76.2   2.195267 1.202886          ?        ? 
1 1 1   22   30    0 o 10.38935 6.056178   9.967218     0.0   1.473535 2.044906   1.473535 2.044906 
1 1 1   22   30    1 o 27.35110 2.473843   36.57891    85.3   7.608253 1.353247          ?        ? 
1 1 1   22   30    2 o 15.52169 4.240324   1.669904   341.2   2.616277 1.353247          ?        ? 
1 1 1   22   30    3 o 30.28351 2.134994   16.93310   336.9   9.292293 1.293102          ?        ? 
1 1 1   22   30    4 f 34.44541 1.920683   35.49594   342.4   11.99879 1.323174          ?        ? 
1 1 1   22   30    5 o 24.89176 2.657856   28.07623    18.3   6.345222 1.323174          ?        ? 
1 1 1   22   30    6 f 40.24611 1.793295   46.70151   202.1   16.38932 1.443463          ?        ? 
1 1 1   22   30    7 o 24.18593 2.797591   21.70607    51.5   6.044501 1.353247          ?        ? 
1 1 1   22   30    8 o 17.15838 3.861518   26.55311    20.0   3.277864 1.293102          ?        ? 
1 1 1   22   30    9 o 30.22679 2.139000   34.64606    68.9   9.382509 1.293102          ?        ? 
1 1 1   22   30   10 o 19.32811 2.956164   26.70020   252.8   3.939451 1.142741          ?        ? 
1 1 1   22   30   11 o 33.63661 1.743359   36.10979   221.4   11.57778 1.172814          ?        ? 
1 1 1   22   30   12 o 8.692113 3.761951   20.14186   213.6  0.1503607 1.202886          ?        ? 
1 1 1   22   30   13 o 7.650051 3.494314   5.391398   305.6 -0.4210100 1.202886          ?        ? 
1 1 1   22   31    0 o 34.67568 2.766249   50.49010     0.0   12.38972 1.894545   12.38972 1.894545 
1 1 1   22   31    1 o 34.24953 2.019471   41.60857   148.8   11.87850 1.383319          ?        ? 
1 1 1   22   31    2 o 32.36525 2.044128   28.94189   223.5   10.61547 1.323174          ?        ? 
1 1 1   22   31    3 o 29.48159 2.244069   33.16564   122.1   8.841210 1.323174          ?        ? 
1 1 1   22   31    4 o 20.36622 3.174625   22.72590    34.5   4.300317 1.293102          ?        ? 
1 1 1   22   31    5 o 35.93012 1.883165   32.05790    80.8   13.08138 1.353247          ?        ? 
1 1 1   22   31    6 o 53.30117 1.466902   54.98050     1.5   28.68883 1.563751          ?        ? 
1 1 1   22   31    7 o 10.38949 4.109730   13.48626   189.3  0.7818757 1.263030          ?        ? 
1 1 1   22   31    8 o 18.55635 3.696359   26.82303   285.6   3.819162 1.323174          ?        ? 
1 1 1   22   31    9 o 34.62080 1.954383   38.46460   226.8   12.26943 1.353247          ?        ? 
1 1 1   22   31   10 o 30.21254 2.189777   36.05468   194.1   9.442654 1.323174          ?        ? 
1 1 1   22   31   11 o 8.270693 3.623158   13.93260    27.4   0.000000 1.142741          ?        ? 
1 1 1   22   31   12 o 35.12716 1.712188   42.45357   273.2   12.75059 1.202886          ?        ? 
1 1 1   22   31   13 o 13.70061 3.813117   13.38146   225.3   2.315555 1.082597          ?        ? 
1 1 1   22   32    0 o 8.298835 5.220366   18.98075   180.0  0.5412986 1.774257  0.5412986 1.774257 
1 1 1   22   32    1 o 43.46084 1.729841   49.49150   231.0   19.09581 1.503607          ?        ? 
1 1 1   22   32    2 o 21.71988 2.976771   14.44087   199.7   4.871688 1.293102          ?        ? 
1 1 1   22   32    3 o 46.37094 1.718559   41.39876   277.7   21.74216 1.593824          ?        ? 
1 1 1   22   32    4 o 17.37662 3.741333   28.95870   322.2   3.307936 1.263030          ?        ? 
1 1 1   22   32    5 o 24.15959 2.862876   17.02766   273.8   6.074574 1.383319          ?        ? 
1 1 1   22   32    6 o 26.60896 2.486332   24.29524   165.4   7.307531 1.323174          ?        ? 
1 1 1   22   32    7 o 16.78975 4.140169   9.535336   175.6   3.217719 1.383319          ?        ? 
1 1 1   22   32    8 o 32.95554 2.098765   37.01004   213.5   11.15676 1.383319          ?        ? 
1 1 1   22   32    9 o 17.97094 3.556945   20.07834   108.6   3.608657 1.232958          ?        ? 
1 1 1   22   32   10 o 31.63712 2.138700   26.65958   263.8   10.40496 1.353247          ?        ? 
1 1 1   22   32   11 o 24.22636 2.420532   22.74397   273.1   6.224934 1.172814          ?        ? 
1 1 1   22   32   12 o 10.69604 3.987414   7.816780   147.0   1.263030 1.142741          ?        ? 
1 1 1   22   33    0 o 30.63808 3.203367   43.32644   180.0   9.893736 1.924617   9.893736 1.924617 
1 1 1   22   33    1 o 21.15351 3.056471   29.87934   281.5   4.661182 1.293102          ?        ? 
1 1 1   22   33    2 o 16.14894 4.090352   19.73324    92.9   2.916998 1.323174          ?        ? 
1 1 1   22   33    3 o 23.28839 2.905411   41.08411   280.8   5.653563 1.353247          ?        ? 
1 1 1   22   33    4 o 15.70140 4.352629   17.98281   278.9   2.796710 1.413391          ?        ? 
1 1 1   22   33    5 o 32.65859 2.209929   24.12686    80.6   10.94626 1.443463          ?        ? 
1 1 1   22   33    6 o 15.48533 4.037153   4.613312    42.8   2.736565 1.263030          ?        ? 
1 1 1   22   33    7 o 9.093623 3.940779   14.16220    60.2       0.06 1.323174          ?        ? 
1 1 1   22   33    8 o 53.17254 1.498728   50.55526   108.2   28.71890 1.593824          ?        ? 
1 1 1   22   33    9 o 15.79216 4.069688   19.97146    91.3   2.947070 1.293102          ?        ? 
1 1 1   22   33   10 o 13.32902 4.282972   24.26369   208.2   2.135122 1.293102          ?        ? 
1 1 1   22   33   11 o 7.698880 3.525397   8.503962   336.9 -0.4510822 1.232958          ?        ? 
1 1 1   22   34    0 o 73.56924 2.026762   82.09174   180.0   54.82152 2.977142   54.82152 2.977142 
1 1 1   22   34    1 o 8.448853 3.764580   1.570198    20.2 -0.3307936 1.293102          ?        ? 
1 1 1   22   34    2 o 27.06911 2.555161   25.56839   107.2   7.578181 1.383319          ?        ? 
1 1 1   22   34    3 o 38.67751 1.866024   48.17814   206.1   15.24658 1.443463          ?        ? 
1 1 1   22   34    4 o 12.91039 4.433167   13.03552   134.2   1.804329 1.383319          ?        ? 
1 1 1   22   34    5 o 31.17649 2.314986   21.84316   234.6   10.04410 1.443463          ?        ? 
1 1 1   22   34    6 o 18.99759 3.854233   14.90723   279.1   4.059740 1.413391          ?        ? 
1 1 1   22   34    7 o 11.06755 4.212840   22.86459   299.5   1.142741 1.293102          ?        ? 
1 1 1   22   34    8 o 8.778409 3.886746   14.68995   203.1      -0.09 1.353247          ?        ? 
1 1 1   22   34    9 o 29.72116 2.327161   28.41795   198.0   9.292293 1.383319          ?        ? 
1 1 1   22   34   10 o 7.273864 3.373163   8.789419   275.6 -0.6315150 1.172814          ?        ? 
1 1 1   22   35    0 f 8.390594 5.415234   2.500544   180.0  0.4210100 2.044906  0.4210100 2.044906 
1 1 1   22   35    1 o 22.58223 3.129432   25.81642   269.0   5.412986 1.413391          ?        ? 
1 1 1   22   35    2 o 9.723831 4.065421   14.72838   205.3  0.4210100 1.323174          ?        ? 
1 1 1   22   35    3 f 31.32793 2.399787   24.91774   127.7   10.16438 1.503607          ?        ? 
1 1 1   22   35    4 o 30.23894 2.386762   37.73415   230.6   9.472726 1.443463          ?        ? 
1 1 1   22   35    5 o 36.23963 2.033044   40.96527   115.2   13.50239 1.473535          ?        ? 
1 1 1   22   35    6 o 24.31503 2.844576   21.00331   163.9   6.285078 1.383319          ?        ? 
1 1 1   22   35    7 o 40.78835 1.916909   42.58955    63.4   17.17119 1.563751          ?        ? 
1 1 1   22   35    8 o 8.213584 3.707963   16.04791     5.8 -0.3007214 1.293102          ?        ? 
1 1 1   22   35    9 o 14.77865 4.312819   29.31835   313.0   2.766637 1.353247          ?        ? 
1 1 1   22   35   10 x        ?      ?   18.00557   323.5          ?        ?          ?        ? 
1 1 1   22   36    0 f 15.60261 6.661059   25.12883   180.0   3.819162 2.105050   3.819162 2.105050 
1 1 1   22   36    1 o 15.87555 4.265070   18.16941   254.4   2.916998 1.383319          ?        ? 
1 1 1   22   36    2 o 16.69624 4.154339   21.58560   208.3   3.217719 1.383319          ?        ? 
1 1 1   22   36    3 o 20.94252 3.302655   20.81475   246.1   4.721327 1.383319          ?        ? 
1 1 1   22   36    4 o 13.82556 4.622838   8.231717   266.0   2.225339 1.503607          ?        ? 
1 1 1   22   36    5 o 24.94284 2.833260   26.72078   191.5   6.645944 1.413391          ?        ? 
1 1 1   22   36    6 f 15.29087 4.512662   17.47701   122.5   2.856854 1.473535          ?        ? 
1 1 1   22   36    7 o 12.26238 4.410794   15.15898   110.3   1.744184 1.383319          ?        ? 
1 1 1   22   36    8 o 33.23893 2.216580   39.49842   112.5   11.69806 1.473535          ?        ? 
1 1 1   22   36    9 o 8.965914 3.935134   15.54241   194.8  0.2405772 1.353247          ?        ? 
1 1 1   22   37    0 o 8.051183 5.337173  0.7812703   360.0       0.09 2.165194       0.09 2.165194 
1 1 1   22   37    1 o 11.98025 4.440815   15.09546    30.2   1.503607 1.413391          ?        ? 
1 1 1   22   37    2 o 9.011389 3.983300   13.16629    82.0      -0.06 1.413391          ?        ? 
1 1 1   22   37    3 o 17.35495 4.054532   9.017598   103.7   3.548513 1.383319          ?        ? 
1 1 1   22   37    4 o 7.259337 3.446357   9.720392   239.6  -1.293102 1.353247          ?        ? 
1 1 1   22   37    5 o 12.14591 4.630022   15.46991   279.4   1.593824 1.563751          ?        ? 
1 1 1   22   37    6 o 7.801105 3.650427   11.17809    71.9 -0.8420200 1.413391          ?        ? 
1 1 1   22   37    7 o 19.34623 3.867334   15.72450    51.5   4.510822 1.443463          ?        ? 
1 1 1   22   38    0 o 7.083884 4.862236   13.26500    -0.0 -0.6916593 2.105050 -0.6916593 2.105050 
1 1 1   22   38    1 o 20.71257 3.411915   25.30445    86.9   4.751399 1.413391          ?        ? 
1 1 1   22   38    2 o 31.29350 2.498525   30.39402    69.4   10.37489 1.563751          ?        ? 
1 1 1   22   38    3 o 9.161530 4.056167   14.60147    73.1       0.03 1.473535          ?        ? 
1 1 1   22   38    4 o 30.26497 2.484072   29.02577   127.9   9.803518 1.503607          ?        ? 
1 1 1   22   38    5 o 11.31686 4.481708   18.24800    31.6   1.353247 1.503607          ?        ? 
1 1 1   22   38    6 o 18.08284 4.228800   15.01218   342.7   4.119884 1.503607          ?        ? 
1 1 1   22   39    0 o 24.48282 5.332447   21.83430   180.0   7.548109 2.285483   7.548109 2.285483 
1 1 1   22   39    1 o 15.43637 4.499025   17.57240   138.6   3.067359 1.473535          ?        ? 
1 1 1   22   39    2 o 12.68101 4.636100   16.44030   257.4   1.984761 1.533679          ?        ? 
1 1 1   22   39    3 o 11.77524 4.525134   7.687943   285.6   1.593824 1.503607          ?        ? 
1 1 1   22   39    4 o 16.23567 4.545002   22.88165   342.3   3.458297 1.533679          ?        ? 
1 1 1   22   40    0 o 16.32014 7.267430   17.78052     0.0   4.871688 2.495988   4.871688 2.495988 
1 1 1   23    0    1 o 10.57633 4.502378   25.58166   270.0   1.593824 0.9623086   1.593824 0.9623086 
1 1 1   23    0    2 o 89.39433 1.295745   133.1757    90.0   79.99191 2.315555   79.99191 2.315555 
1 1 1   23    0    3 o 24.73590 2.095676   26.43164   270.0   6.255006 1.022453   6.255006 1.022453 
1 1 1   23    0    4 o 116.6119 1.470454   128.8484   270.0   136.1065 3.428224   136.1065 3.428224 
1 1 1   23    0    5 o 110.9656 1.314785   123.2036   270.0   123.2356 2.916998   123.2356 2.916998 
1 1 1   23    0    6 o 7.103356 3.983866   22.38141    90.0  0.6916593 0.8420200  0.6916593 0.8420200 
1 1 1   23    0    7 o 32.85282 1.378283   34.96880    90.0   10.85604 0.9021643   10.85604 0.9021643 
1 1 1   23    0    8 f 149.0425 1.644866   223.6568    90.0   222.3835 4.901759   222.3835 4.901759 
1 1 1   23    0    9 o 99.16607 1.183054   158.6770    90.0   98.42612 2.345627   98.42612 2.345627 
1 1 1   23    0   10 f 6.195181 3.603866   28.91780   270.0  0.4811543 0.7217315  0.4811543 0.7217315 
1 1 1   23    0   11 o 45.65183 3.261204   71.48309    90.0   21.26101 2.947070   21.26101 2.947070 
1 1 1   23    0   12 o 10.88967 6.424346   21.59928   270.0   1.473535 2.345627   1.473535 2.345627 
1 1 1   23    0   13 x        ?      ?   62.69212   270.0          ?        ?          ?        ? 
1 1 1   23    0   14 x        ?      ?   4.431328    90.0          ?        ?          ?        ? 
1 1 1   23    0   15 o 6.677094 4.785607   16.88588   270.0  -3.247792 2.676421  -3.247792 2.676421 
1 1 1   23    0   16 x        ?      ?   48.74897    90.0          ?        ?          ?        ? 
1 1 1   23    0   17 o 10.83303 5.987564   21.36682   270.0   1.864473 1.864473   1.864473 1.864473 
1 1 1   23    0   18 x        ?      ?   2.489349    90.0          ?        ?          ?        ? 
1 1 1   23    0   19 o 26.20218 6.147870   31.42996   270.0   8.781067 2.796710   8.781067 2.796710 
1 1 1   23    0   20 o 5.851407 4.133178   3.620508   270.0  -1.323174 1.804329  -1.323174 1.804329 
1 1 1   23    1    0 o 47.04719 1.312600   56.93242   360.0   22.19324 1.232958   22.19324 1.232958 
1 1 1   23    1    1 o 65.61185 0.9166681   122.6893   164.9   43.06331 1.202886          ?        ? 
1 1 1   23    1    2 o 31.82509 1.181149   36.03377   282.9   10.13431 0.7518036          ?        ? 
1 1 1   23    1    3 o 87.41608 0.9288313   121.5831   246.0   76.44339 1.623896          ?        ? 
1 1 1   23    1    4 o 7.592244 2.983502   29.97145   329.4  0.3307936 0.6615872          ?        ? 
1 1 1   23    1    5 o 69.59221 0.8210269   93.12236   163.4   48.44623 1.142741          ?        ? 
1 1 1   23    1    6 o 59.18037 0.8130302   92.39091   101.3   35.03405 0.9623086          ?        ? 
1 1 1   23    1    7 o 90.48754 0.8640701   101.5471   285.7   81.91652 1.563751          ?        ? 
1 1 1   23    1    8 o 9.519383 2.711587   24.75052    76.0  0.9322364 0.5412986          ?        ? 
1 1 1   23    1    9 o 47.00622 0.7037230   60.61982   145.2   22.10303 0.6615872          ?        ? 
1 1 1   23    1   10 o 55.66711 1.431567   79.79945    53.2   31.03445 1.593824          ?        ? 
1 1 1   23    1   11 o 48.92981 1.075546   55.69615   171.3   23.96750 1.052525          ?        ? 
1 1 1   23    1   12 o 34.25510 5.179540   41.99405   210.2   12.11907 3.548513          ?        ? 
1 1 1   23    1   13 x        ?      ?   97.93529   269.8          ?        ?          ?        ? 
1 1 1   23    1   14 o 37.54834 2.963299   44.12240   316.9   14.37449 2.225339          ?        ? 
1 1 1   23    1   15 o 16.20013 6.139683   28.06474   335.6   2.375700 2.736565          ?        ? 
1 1 1   23    1   16 o 23.79985 5.691268   35.84785    22.6   6.555727 2.676421          ?        ? 
1 1 1   23    1   17 o 32.38762 2.692672   46.97651   294.3   10.88612 1.744184          ?        ? 
1 1 1   23    1   18 f 13.00302 4.647590   14.35719   259.2   1.804329 1.533679          ?        ? 
1 1 1   23    1   19 o 17.01444 5.661796   13.17127   308.3   3.879307 2.255411          ?        ? 
1 1 1   23    1   20 o 16.30257 4.981805   22.46776   212.2   3.668802 1.774257          ?        ? 
1 1 1   23    2    0 o 75.50779 1.235362   96.07373   180.0   57.07693 1.864473   57.07693 1.864473 
1 1 1   23    2    1 o 97.45014 0.9257702   150.6898   163.6   94.99790 1.804329          ?        ? 
1 1 1   23    2    2 o 143.3593 1.143234   161.3138   200.3   205.6333 3.277864          ?        ? 
1 1 1   23    2    3 f 57.03262 0.8963756   52.00022   246.1   32.53806 1.022453          ?        ? 
1 1 1   23    2    4 o 93.49883 0.9166489   151.0465     1.4   87.44979 1.714112          ?        ? 
1 1 1   23    2    5 o 28.37797 1.271640   34.52200   177.3   8.059335 0.7217315          ?        ? 
1 1 1   23    2    6 o 85.83836 0.8408031   134.4334   255.4   73.70683 1.443463          ?        ? 
1 1 1   23    2    7 o 57.21497 0.8146788   72.36303    18.6   32.74857 0.9322364          ?        ? 
1 1 1   23    2    8 o 49.46536 0.8815181   82.34318   121.5   24.47873 0.8720922          ?        ? 
1 1 1   23    2    9 o 53.31780 1.043431   68.87103    64.8   28.44825 1.112669          ?        ? 
1 1 1   23    2   10 o 58.19107 1.085244   83.98672   116.5   33.89131 1.263030          ?        ? 
1 1 1   23    2   11 f 29.85306 1.511008   59.29214   121.8   8.931427 0.9021643          ?        ? 
1 1 1   23    2   12 o 22.89631 1.773097   29.00768   143.4   5.262625 0.8119479          ?        ? 
1 1 1   23    2   13 o 34.00143 0.9728815   41.22108    12.3   11.57778 0.6615872          ?        ? 
1 1 1   23    2   14 o 25.73105 3.447696   33.20986     5.3   6.796305 1.774257          ?        ? 
1 1 1   23    2   15 o 27.31616 4.073301   39.70288   322.6   7.818758 2.225339          ?        ? 
1 1 1   23    2   16 o 23.12901 3.510517   12.26771   135.5   5.593419 1.623896          ?        ? 
1 1 1   23    2   17 o 29.21033 3.603263   33.45078   119.4   9.111859 2.105050          ?        ? 
1 1 1   23    2   18 o 28.14033 3.793705   37.27214    92.7   8.660777 2.135122          ?        ? 
1 1 1   23    2   19 o 19.38906 2.093830   27.46787   115.8   3.909379 0.8119479          ?        ? 
1 1 1   23    2   20 o 15.39369 3.136755   24.97339   109.3   2.736565 0.9322364          ?        ? 
1 1 1   23    3    0 f 20.14466 2.448464   86.90517   180.0   4.240172 0.9623086   4.240172 0.9623086 
1 1 1   23    3    1 o 88.20339 0.9375876   131.6010   190.8   77.82671 1.653968          ?        ? 
1 1 1   23    3    2 o 90.77300 0.9276107   165.6328   104.4   82.42775 1.684040          ?        ? 
1 1 1   23    3    3 o 105.9169 0.9937268   157.0359   270.5   112.2292 2.105050          ?        ? 
1 1 1   23    3    4 o 85.97869 0.8918951   129.8907   195.5   73.94740 1.533679          ?        ? 
1 1 1   23    3    5 o 53.41156 0.8726917   88.85330   147.6   28.53847 0.9322364          ?        ? 
1 1 1   23    3    6 o 14.59409 2.266628   15.96094    28.7   2.135122 0.6615872          ?        ? 
1 1 1   23    3    7 o 51.74979 0.9297706   58.86843   216.5   26.79428 0.9623086          ?        ? 
1 1 1   23    3    8 o 63.93892 0.8465870   97.00781   233.7   40.89812 1.082597          ?        ? 
1 1 1   23    3    9 o 66.48441 1.085565   93.10587   162.0   44.23613 1.443463          ?        ? 
1 1 1   23    3   10 f 84.91533 1.115550   117.0108   195.2   72.17315 1.894545          ?        ? 
1 1 1   23    3   11 o 15.82920 3.151461   28.97917   118.2   2.616277 0.9623086          ?        ? 
1 1 1   23    3   12 o 20.66430 2.401196   35.45554   321.2   4.300317 0.9923807          ?        ? 
1 1 1   23    3   13 o 37.31674 1.652017   43.06122   228.0   13.98355 1.232958          ?        ? 
1 1 1   23    3   14 o 24.77511 1.395875   31.36695    55.2   6.164790 0.6916593          ?        ? 
1 1 1   23    3   15 o 35.83006 1.300914   43.89534   341.1   12.90095 0.9322364          ?        ? 
1 1 1   23    3   16 o 44.45397 1.082365   62.74008     8.0   19.84762 0.9623086          ?        ? 
1 1 1   23    3   17 o 6.621276 2.890144   8.818265    54.9      -0.09 0.7217315          ?        ? 
1 1 1   23    3   18 o 16.09279 2.616141   22.67721    18.7   2.706493 0.8420200          ?        ? 
1 1 1   23    3   19 o 17.21789 2.445189   19.52493   174.2   3.127503 0.8420200          ?        ? 
1 1 1   23    3   20 f 10.32487 3.682330   6.037929   291.0   1.202886 0.9623086          ?        ? 
1 1 1   23    4    0 o 23.49470 2.078820   43.96090   360.0   5.653563 0.9623086   5.653563 0.9623086 
1 1 1   23    4    1 o 51.98615 0.8966201   62.03034   285.9   27.03486 0.9322364          ?        ? 
1 1 1   23    4    2 o 63.37448 0.8778528   81.72530   169.1   40.17639 1.112669          ?        ? 
1 1 1   23    4    3 o 20.05994 1.873893   30.84405   265.4   4.029667 0.7518036          ?        ? 
1 1 1   23    4    4 o 25.47466 1.475591   57.03238    53.7   6.495584 0.7518036          ?        ? 
1 1 1   23    4    5 o 45.44122 1.025761   28.31800   333.2   20.65956 0.9322364          ?        ? 
1 1 1   23    4    6 o 51.16700 0.9697469   79.01338    83.3   26.19284 0.9923807          ?        ? 
1 1 1   23    4    7 o 122.9673 1.124948   170.7166    14.4   151.3230 2.766637          ?        ? 
1 1 1   23    4    8 o 79.72536 1.075011   123.4431   338.1   63.60258 1.714112          ?        ? 
1 1 1   23    4    9 o 21.20912 2.055937   42.10004   128.2   4.510822 0.8720922          ?        ? 
1 1 1   23    4   10 o 12.37926 3.413849   11.08017   207.2   1.593824 0.8720922          ?        ? 
1 1 1   23    4   11 o 28.75495 1.987035   17.84736   300.3   8.299912 1.142741          ?        ? 
1 1 1   23    4   12 o 7.486489 3.402656   3.677389   238.4 -0.6615872 1.112669          ?        ? 
1 1 1   23    4   13 o 27.69050 2.280620   43.26559   328.9   7.728541 1.263030          ?        ? 
1 1 1   23    4   14 o 37.61209 1.838928   55.10207   303.0   14.25420 1.383319          ?        ? 
1 1 1   23    4   15 o 39.90775 1.243344   48.27940   283.5   15.99838 0.9923807          ?        ? 
1 1 1   23    4   16 o 41.41399 1.307043   54.61148   306.0   17.26141 1.082597          ?        ? 
1 1 1   23    4   17 o 9.076948 3.547418   14.66755   201.3  0.6014429 0.9322364          ?        ? 
1 1 1   23    4   18 o 19.81144 2.504565   15.98032   246.0   4.089812 0.9923807          ?        ? 
1 1 1   23    4   19 o 13.69733 3.499556   13.32308   271.4   2.165194 0.9623086          ?        ? 
1 1 1   23    4   20 o 9.801701 3.741694   8.132434   223.0  0.9923807 1.022453          ?        ? 
1 1 1   23    5    0 o 7.522709 4.284935   1.818059     0.0  0.7518036 0.9923807  0.7518036 0.9923807 
1 1 1   23    5    1 o 34.89078 1.034273   97.29970    88.1   12.17922 0.7217315          ?        ? 
1 1 1   23    5    2 o 66.79232 0.9004672   108.1781    64.3   44.62706 1.202886          ?        ? 
1 1 1   23    5    3 o 33.25731 1.175495   53.95720   158.5   11.06655 0.7818757          ?        ? 
1 1 1   23    5    4 o 88.18099 1.040134   129.2018   345.3   77.79664 1.834401          ?        ? 
1 1 1   23    5    5 o 69.04388 1.023545   115.3240   208.2   47.69442 1.413391          ?        ? 
1 1 1   23    5    6 o 27.99666 1.611200   22.48441   318.8   7.848830 0.9021643          ?        ? 
1 1 1   23    5    7 o 58.07235 0.9321108   62.31268   296.6   33.74094 1.082597          ?        ? 
1 1 1   23    5    8 o 79.80103 1.055149   102.1192    54.0   63.72287 1.684040          ?        ? 
1 1 1   23    5    9 o 80.03976 1.089574   108.5692   226.9   64.11382 1.744184          ?        ? 
1 1 1   23    5   10 o 57.45851 1.151417   74.99026   235.7   33.04929 1.323174          ?        ? 
1 1 1   23    5   11 o 31.42202 2.296897   42.12408   338.0   9.923808 1.443463          ?        ? 
1 1 1   23    5   12 o 18.08226 3.535390   29.85486   179.6   3.428224 1.232958          ?        ? 
1 1 1   23    5   13 o 44.53149 1.586957   63.51501     5.9   19.90776 1.413391          ?        ? 
1 1 1   23    5   14 o 46.93000 1.666047   54.36551   178.3   22.16317 1.563751          ?        ? 
1 1 1   23    5   15 o 27.96500 2.527071   36.19218   141.3   7.969118 1.413391          ?        ? 
1 1 1   23    5   16 o 38.40377 1.370341   50.35994    56.1   14.85564 1.052525          ?        ? 
1 1 1   23    5   17 o 33.79069 1.735410   39.31997    94.3   11.60785 1.172814          ?        ? 
1 1 1   23    5   18 o 21.84490 2.409086   31.22907   276.0   4.961904 1.052525          ?        ? 
1 1 1   23    5   19 o 11.51894 3.867746   7.691587    66.3   1.503607 1.052525          ?        ? 
1 1 1   23    6    0 o 32.34075 1.730680   35.95895   360.0   10.55532 1.112669   10.55532 1.112669 
1 1 1   23    6    1 o 59.68357 0.9825264   84.59481   349.9   35.63549 1.172814          ?        ? 
1 1 1   23    6    2 o 46.58632 1.032823   87.36777    55.6   21.71209 0.9623086          ?        ? 
1 1 1   23    6    3 o 44.50753 1.013496   46.75881   281.8   19.81754 0.9021643          ?        ? 
1 1 1   23    6    4 o 65.40159 0.9655959   88.78795   147.0   42.79266 1.263030          ?        ? 
1 1 1   23    6    5 o 39.22675 1.149935   40.55556    45.1   15.39694 0.9021643          ?        ? 
1 1 1   23    6    6 o 96.30430 1.046077   138.7320   287.5   92.80264 2.014834          ?        ? 
1 1 1   23    6    7 o 126.6641 1.139599   155.5291   173.5   160.5552 2.886926          ?        ? 
1 1 1   23    6    8 o 26.27132 1.888715   27.61019   337.3   6.916593 0.9923807          ?        ? 
1 1 1   23    6    9 o 62.85837 1.124266   71.73006   171.6   39.54487 1.413391          ?        ? 
1 1 1   23    6   10 o 24.79082 1.940857   30.72475   238.1   6.164790 0.9623086          ?        ? 
1 1 1   23    6   11 o 44.64974 1.279673   66.37948   311.5   19.96791 1.142741          ?        ? 
1 1 1   23    6   12 o 26.37085 2.508782   25.93231   116.6   7.006810 1.323174          ?        ? 
1 1 1   23    6   13 o 16.77356 4.286394   22.58513   301.5   3.007215 1.443463          ?        ? 
1 1 1   23    6   14 o 37.41314 2.049654   35.80567    90.2   14.13391 1.533679          ?        ? 
1 1 1   23    6   15 o 26.91667 2.625494   34.76024   305.1   7.397748 1.413391          ?        ? 
1 1 1   23    6   16 o 31.75092 2.225748   40.25016    33.1   10.28467 1.413391          ?        ? 
1 1 1   23    6   17 f 22.07539 2.520158   29.14078   128.9   5.052120 1.112669          ?        ? 
1 1 1   23    6   18 o 28.21429 1.971819   38.29298    66.0   8.179624 1.112669          ?        ? 
1 1 1   23    6   19 o 24.80158 2.364393   32.63213    64.1   6.495584 1.172814          ?        ? 
1 1 1   23    7    0 o 89.47201 1.614486   125.8496   180.0   80.17234 2.886926   80.17234 2.886926 
1 1 1   23    7    1 o 13.68329 3.141439   13.47121   267.7   1.954689 0.8420200          ?        ? 
1 1 1   23    7    2 f 58.15081 1.085995   85.84276   184.9   33.83116 1.263030          ?        ? 
1 1 1   23    7    3 o 27.23405 1.821949   36.40581   130.8   7.427820 0.9923807          ?        ? 
1 1 1   23    7    4 o 48.72890 1.018267   62.82906   207.5   23.75699 0.9923807          ?        ? 
1 1 1   23    7    5 o 57.76202 0.9891807   60.65681   293.7   33.38008 1.142741          ?        ? 
1 1 1   23    7    6 o 28.68784 1.415143   52.20947   350.0   8.239767 0.8119479          ?        ? 
1 1 1   23    7    7 o 77.45955 0.8541067   125.8945    54.6   60.02400 1.323174          ?        ? 
1 1 1   23    7    8 o 39.33152 1.338017   43.41924     8.6   15.48715 1.052525          ?        ? 
1 1 1   23    7    9 o 50.23040 1.317105   53.23479   357.2   25.26060 1.323174          ?        ? 
1 1 1   23    7   10 o 35.79075 1.680442   51.34766    24.3   12.84081 1.202886          ?        ? 
1 1 1   23    7   11 o 20.81042 2.601095   15.25864   348.1   4.360461 1.082597          ?        ? 
1 1 1   23    7   12 o 36.94962 1.871898   52.58005   143.3   13.71290 1.383319          ?        ? 
1 1 1   23    7   13 o 36.36563 2.026000   45.54291   276.7   13.32196 1.473535          ?        ? 
1 1 1   23    7   14 o 76.45012 1.494754   100.8899    12.0   58.76097 2.285483          ?        ? 
1 1 1   23    7   15 o 18.94322 3.864426   24.28338   100.5   3.879307 1.413391          ?        ? 
1 1 1   23    7   16 o 31.77562 2.365977   42.42116   105.7   10.34482 1.503607          ?        ? 
1 1 1   23    7   17 o 10.02493 3.843401   15.47299   308.3  0.8420200 1.082597          ?        ? 
1 1 1   23    7   18 o 10.29497 3.911059   9.719327    24.6  0.9623086 1.112669          ?        ? 
1 1 1   23    7   19 o 10.43980 4.116013   11.11407    94.0   1.022453 1.263030          ?        ? 
1 1 1   23    8    0 o 17.29855 3.656481   6.385788   360.0   3.368080 1.112669   3.368080 1.112669 
1 1 1   23    8    1 o 38.91832 1.274953   62.35190   312.5   15.15636 0.9923807          ?        ? 
1 1 1   23    8    2 o 91.21033 1.137469   126.3650     9.5   83.23969 2.074978          ?        ? 
1 1 1   23    8    3 o 42.39346 1.134973   53.05378   158.8   17.98314 0.9623086          ?        ? 
1 1 1   23    8    4 o 64.47408 1.026129   72.21964     4.6   41.58978 1.323174          ?        ? 
1 1 1   23    8    5 o 37.13643 1.295640   61.74223   154.0   13.80311 0.9623086          ?        ? 
1 1 1   23    8    6 o 27.72714 1.518404   54.39746   159.0   7.698469 0.8420200          ?        ? 
1 1 1   23    8    7 o 117.8589 1.058888   163.8543   255.4   138.9935 2.495988          ?        ? 
1 1 1   23    8    8 o 15.61637 3.546286   7.501902   133.0   2.556132 1.082597          ?        ? 
1 1 1   23    8    9 o 70.97821 1.207492   86.98028   285.5   50.43098 1.714112          ?        ? 
1 1 1   23    8   10 o 57.89071 1.246714   88.62191   250.4   33.56051 1.443463          ?        ? 
1 1 1   23    8   11 o 41.20314 1.532686   55.14884    46.8   17.02083 1.263030          ?        ? 
1 1 1   23    8   12 o 19.52713 3.600135   17.26174   230.0   3.999595 1.353247          ?        ? 
1 1 1   23    8   13 o 21.02927 3.146030   16.54891   355.1   4.510822 1.323174          ?        ? 
1 1 1   23    8   14 o 9.023262 3.802651   4.309083   216.0  0.1503607 1.172814          ?        ? 
1 1 1   23    8   15 o 33.86989 2.264075   49.18363   106.9   11.66799 1.533679          ?        ? 
1 1 1   23    8   16 o 10.71929 4.392939   3.694199   240.0  0.6315150 1.503607          ?        ? 
1 1 1   23    8   17 o 15.06344 4.349081   18.08360   223.5   2.616277 1.383319          ?        ? 
1 1 1   23    8   18 o 20.56310 2.924865   33.45777   253.1   4.510822 1.202886          ?        ? 
1 1 1   23    8   19 o 11.00016 3.955932   21.41499   165.7   1.353247 1.112669          ?        ? 
1 1 1   23    9    0 o 34.50888 2.152272   26.71449   180.0   12.05893 1.473535   12.05893 1.473535 
1 1 1   23    9    1 o 68.30053 1.034685   84.66740   201.3   46.67197 1.413391          ?        ? 
1 1 1   23    9    2 o 13.89454 3.006818   37.20044   167.1   2.014834 0.8119479          ?        ? 
1 1 1   23    9    3 o 60.15382 1.124822   99.95032   288.0   36.20686 1.353247          ?        ? 
1 1 1   23    9    4 o 29.97193 1.404681   31.15805   351.7   8.991571 0.8420200          ?        ? 
1 1 1   23    9    5 o 45.23719 1.130102   68.93260    85.2   20.47913 1.022453          ?        ? 
1 1 1   23    9    6 o 48.91071 1.045224   79.17316   179.7   23.93743 1.022453          ?        ? 
1 1 1   23    9    7 o 48.54521 0.8672535   82.71197   276.8   23.57656 0.8420200          ?        ? 
1 1 1   23    9    8 o 79.17927 1.272324   118.3215   325.9   62.76057 2.014834          ?        ? 
1 1 1   23    9    9 o 47.07495 1.405391   53.52617   149.6   22.19324 1.323174          ?        ? 
1 1 1   23    9   10 o 47.15933 1.434760   82.89371   359.0   22.28346 1.353247          ?        ? 
1 1 1   23    9   11 o 28.10288 2.086643   59.15134   323.0   7.939046 1.172814          ?        ? 
1 1 1   23    9   12 o 74.56542 1.209896   103.6163    27.5   55.72369 1.804329          ?        ? 
1 1 1   23    9   13 o 21.48705 3.218959   47.75457    99.7   4.721327 1.383319          ?        ? 
1 1 1   23    9   14 o 10.67963 4.177114   4.743041    71.8  0.7818757 1.293102          ?        ? 
1 1 1   23    9   15 o 24.35976 2.592452   30.64764   254.9   6.074574 1.263030          ?        ? 
1 1 1   23    9   16 o 8.060277 3.676008   7.765948   297.2 -0.6916593 1.323174          ?        ? 
1 1 1   23    9   17 o 28.69047 2.567987   32.80925   147.4   8.570561 1.473535          ?        ? 
1 1 1   23    9   18 o 28.66351 2.727774   29.61499   120.7   8.720922 1.563751          ?        ? 
1 1 1   23    9   19 o 16.71779 3.929438   18.84157   320.2   3.398152 1.293102          ?        ? 
1 1 1   23   10    0 o 17.74271 4.200426   26.69214   360.0   3.638730 1.293102   3.638730 1.293102 
1 1 1   23   10    1 o 188.5352 1.666818   225.6882    23.8   355.9339 6.285078          ?        ? 
1 1 1   23   10    2 o 10.78726 3.455116   16.40659   264.6   1.142741 0.8420200          ?        ? 
1 1 1   23   10    3 o 73.12218 1.089836   90.09066   186.0   53.49834 1.593824          ?        ? 
1 1 1   23   10    4 o 42.42387 1.275929   65.93003   161.5   18.01322 1.082597          ?        ? 
1 1 1   23   10    5 o 108.7608 1.216591   143.0913   218.6   118.3940 2.646349          ?        ? 
1 1 1   23   10    6 o 17.05988 2.027151   48.63629   238.4   2.916998 0.6916593          ?        ? 
1 1 1   23   10    7 o 29.61928 1.218347   58.16824   328.5   8.781067 0.7217315          ?        ? 
1 1 1   23   10    8 o 78.31987 1.286285   78.55754   206.5   61.40732 2.014834          ?        ? 
1 1 1   23   10    9 o 34.72566 1.775284   38.28745   188.5   12.08900 1.232958          ?        ? 
1 1 1   23   10   10 o 64.85572 1.298297   99.37257   276.4   42.13108 1.684040          ?        ? 
1 1 1   23   10   11 o 51.96779 1.330938   52.01060   327.6   27.06493 1.383319          ?        ? 
1 1 1   23   10   12 o 8.303812 3.606339   14.85086   164.6 -0.1503607 1.112669          ?        ? 
1 1 1   23   10   13 o 45.35289 1.624522   61.03622   206.3   20.68964 1.473535          ?        ? 
1 1 1   23   10   14 f 32.17672 2.196294   30.82966     3.1   10.49518 1.413391          ?        ? 
1 1 1   23   10   15 o 32.31171 2.140584   41.19255    41.4   10.61547 1.383319          ?        ? 
1 1 1   23   10   16 o 8.282034 3.666034   8.504265   150.6 -0.2405772 1.202886          ?        ? 
1 1 1   23   10   17 o 41.91722 1.721802   48.79768    80.8   17.89293 1.443463          ?        ? 
1 1 1   23   10   18 o 21.98430 3.214545   11.99470    39.8   5.262625 1.413391          ?        ? 
1 1 1   23   10   19 o 14.56756 4.502025   16.24503   227.9   2.736565 1.443463          ?        ? 
1 1 1   23   11    0 o 77.99070 1.505037   96.35627     0.0   60.92617 2.345627   60.92617 2.345627 
1 1 1   23   11    1 f 79.65473 1.057087   121.2924   300.9   63.48230 1.684040          ?        ? 
1 1 1   23   11    2 o 119.5253 1.220243   147.2749    74.6   142.9630 2.916998          ?        ? 
1 1 1   23   11    3 o 144.4665 1.394672   211.5353   152.5   208.9112 4.029667          ?        ? 
1 1 1   23   11    4 o 62.26419 1.038400   61.46012   172.5   38.79307 1.293102          ?        ? 
1 1 1   23   11    5 o 59.70068 1.082988   78.49065   243.1   35.66556 1.293102          ?        ? 
1 1 1   23   11    6 o 37.22004 1.131138   40.06109   318.5   13.86326 0.8420200          ?        ? 
1 1 1   23   11    7 o 72.17175 0.8958507   97.52907   170.0   52.11503 1.293102          ?        ? 
1 1 1   23   11    8 f 65.35691 1.265335   120.4914    71.9   42.76259 1.653968          ?        ? 
1 1 1   23   11    9 o 34.58496 1.912934   54.48533   137.7   11.99879 1.323174          ?        ? 
1 1 1   23   11   10 o 46.60075 1.613286   63.93042   351.4   21.77223 1.503607          ?        ? 
1 1 1   23   11   11 o 97.60464 1.263216   124.5217    68.5   95.44898 2.465916          ?        ? 
1 1 1   23   11   12 o 8.642858 3.648438   18.58152    54.7       0.09 1.082597          ?        ? 
1 1 1   23   11   13 o 21.62923 3.128281   27.57967   272.2   4.781471 1.353247          ?        ? 
1 1 1   23   11   14 f 17.11553 4.090810   21.60424   324.3   3.187647 1.383319          ?        ? 
1 1 1   23   11   15 o 32.62082 2.166394   31.43602   205.0   10.82597 1.413391          ?        ? 
1 1 1   23   11   16 o 16.17630 4.086206   17.84633   151.5   2.947070 1.323174          ?        ? 
1 1 1   23   11   17 f 41.60612 1.843094   37.49280    88.3   17.68242 1.533679          ?        ? 
1 1 1   23   11   18 o 10.33654 4.251451   16.48415    33.0  0.7518036 1.413391          ?        ? 
1 1 1   23   11   19 o 14.33748 4.568517   21.38502   151.9   2.676421 1.473535          ?        ? 
1 1 1   23   12    0 o 87.00311 1.556513   111.7271   180.0   75.81188 2.706493   75.81188 2.706493 
1 1 1   23   12    1 o 29.36122 1.536319   19.84162   242.5   8.630706 0.9021643          ?        ? 
1 1 1   23   12    2 o 35.05127 1.458511   53.26569   349.7   12.29951 1.022453          ?        ? 
1 1 1   23   12    3 o 12.39131 3.412390   23.52794    92.7   1.593824 0.8720922          ?        ? 
1 1 1   23   12    4 o 59.16783 1.118154   76.13039   139.1   35.03405 1.323174          ?        ? 
1 1 1   23   12    5 o 8.670029 3.179300   7.251428     9.0  0.6014429 0.7217315          ?        ? 
1 1 1   23   12    6 o 95.17140 1.058529   120.7044    93.2   90.63744 2.014834          ?        ? 
1 1 1   23   12    7 f 35.31376 1.064463   31.82596   110.3   12.47994 0.7518036          ?        ? 
1 1 1   23   12    8 o 48.51572 1.487624   67.96021    60.6   23.57656 1.443463          ?        ? 
1 1 1   23   12    9 o 23.89593 2.516926   30.06276   182.2   5.743780 1.202886          ?        ? 
1 1 1   23   12   10 o 85.54693 1.283077   107.7637   355.1   73.31589 2.195267          ?        ? 
1 1 1   23   12   11 o 16.16488 3.783704   9.338592   258.9   2.766637 1.202886          ?        ? 
1 1 1   23   12   12 o 54.47696 1.324838   63.94526   149.1   29.77142 1.443463          ?        ? 
1 1 1   23   12   13 o 38.61428 2.102714   45.15739   355.6   15.06614 1.623896          ?        ? 
1 1 1   23   12   14 o 34.09238 2.161092   47.20141    75.3   11.78828 1.473535          ?        ? 
1 1 1   23   12   15 o 13.32394 4.529446   10.35476    66.7   1.834401 1.443463          ?        ? 
1 1 1   23   12   16 o 17.60044 3.864087   27.01254   307.9   3.458297 1.323174          ?        ? 
1 1 1   23   12   17 o 25.39978 2.959883   25.01302   280.8   6.826377 1.503607          ?        ? 
1 1 1   23   12   18 o 16.92883 4.400900   14.88053   242.9   3.488369 1.503607          ?        ? 
1 1 1   23   12   19 o 8.537994 3.902753   12.20793    69.0 -0.3608657 1.503607          ?        ? 
1 1 1   23   13    0 o 49.41655 1.555175   84.57295   180.0   24.50880 1.533679   24.50880 1.533679 
1 1 1   23   13    1 f 114.1366 1.277854   179.6089   141.0   130.3928 2.916998          ?        ? 
1 1 1   23   13    2 o 89.64048 1.107068   94.07932   176.9   80.41291 1.984761          ?        ? 
1 1 1   23   13    3 o 94.99344 1.139655   146.9134    53.2   90.30665 2.165194          ?        ? 
1 1 1   23   13    4 o 70.33480 1.026137   112.4626    78.8   49.49875 1.443463          ?        ? 
1 1 1   23   13    5 o 49.67325 1.029179   71.70127    44.7   24.68923 1.022453          ?        ? 
1 1 1   23   13    6 o 11.99967 3.108368   18.30193    37.5   1.503607 0.7518036          ?        ? 
1 1 1   23   13    7 o 36.60625 1.150104   58.61699    55.2   13.41218 0.8420200          ?        ? 
1 1 1   23   13    8 o 38.80153 0.9300297   53.06393   105.6   15.06614 0.7217315          ?        ? 
1 1 1   23   13    9 f 55.94791 1.451257   96.13214   180.0   31.36525 1.623896          ?        ? 
1 1 1   23   13   10 o 87.53424 1.271125   108.9858   209.5   76.77419 2.225339          ?        ? 
1 1 1   23   13   11 o 46.96825 1.472611   64.63797   222.5   22.13310 1.383319          ?        ? 
1 1 1   23   13   12 o 39.99888 1.616423   43.80326   204.3   16.08860 1.293102          ?        ? 
1 1 1   23   13   13 o 9.815713 3.743252   27.27485   268.8  0.7217315 1.022453          ?        ? 
1 1 1   23   13   14 o 13.76271 4.321904   10.17289    71.2   2.014834 1.323174          ?        ? 
1 1 1   23   13   15 o 29.30661 2.565304   33.43556   172.1   8.841210 1.503607          ?        ? 
1 1 1   23   13   16 o 11.21207 4.437783   20.50823   340.7  0.9923807 1.473535          ?        ? 
1 1 1   23   13   17 o 25.78696 2.507280   29.72258   275.6   6.946666 1.293102          ?        ? 
1 1 1   23   13   18 o 16.23375 4.288568   16.27995   342.4   3.217719 1.413391          ?        ? 
1 1 1   23   14    0 o 57.28868 1.656565   95.89551   180.0   32.92900 1.894545   32.92900 1.894545 
1 1 1   23   14    1 o 76.07781 1.087024   106.0585   148.2   57.91895 1.653968          ?        ? 
1 1 1   23   14    2 o 92.19895 1.174197   92.72890   352.7   85.07410 2.165194          ?        ? 
1 1 1   23   14    3 o 71.57964 1.134328   101.2131    44.2   51.27301 1.623896          ?        ? 
1 1 1   23   14    4 o 49.61205 1.060755   61.62897   290.1   24.62909 1.052525          ?        ? 
1 1 1   23   14    5 o 45.99485 1.078796   60.43932    55.2   21.17079 0.9923807          ?        ? 
1 1 1   23   14    6 o 75.44588 0.9765510   100.4982   306.9   56.95664 1.473535          ?        ? 
1 1 1   23   14    7 o 31.34202 1.199354   19.93727   206.5   9.833591 0.7518036          ?        ? 
1 1 1   23   14    8 o 70.03005 0.9017771   80.04151   258.0   49.07774 1.263030          ?        ? 
1 1 1   23   14    9 o 59.36226 1.367785   69.70807   169.6   35.30470 1.623896          ?        ? 
1 1 1   23   14   10 o 79.08475 1.444958   100.9026   165.4   62.70042 2.285483          ?        ? 
1 1 1   23   14   11 o 22.28008 2.766952   25.52949   312.8   5.022048 1.232958          ?        ? 
1 1 1   23   14   12 o 12.67576 4.134795   23.34504   347.7   1.623896 1.202886          ?        ? 
1 1 1   23   14   13 f 21.14054 2.844974   50.43222   211.5   4.570966 1.202886          ?        ? 
1 1 1   23   14   14 o 10.40472 4.230346   17.51551   242.6  0.5713707 1.383319          ?        ? 
1 1 1   23   14   15 o 21.44933 3.434921   30.10639    16.0   4.871688 1.473535          ?        ? 
1 1 1   23   14   16 o 9.368543 3.866308   11.97663    59.1  0.4510822 1.172814          ?        ? 
1 1 1   23   14   17 o 16.40709 3.976515   14.00813    95.2   3.127503 1.293102          ?        ? 
1 1 1   23   14   18 o 7.636104 3.642546   10.74781    57.5  -1.383319 1.533679          ?        ? 
1 1 1   23   15    0 o 4.375352 3.166714   20.99294   180.0  -2.044906 1.293102  -2.044906 1.293102 
1 1 1   23   15    1 o 145.2529 1.438879   183.5080   285.4   211.2267 4.180028          ?        ? 
1 1 1   23   15    2 o 42.06368 1.394093   48.46608   330.5   17.71249 1.172814          ?        ? 
1 1 1   23   15    3 o 89.07382 1.046589   106.8927     5.3   79.39046 1.864473          ?        ? 
1 1 1   23   15    4 o 45.60118 1.088109   69.10316   358.6   20.80992 0.9923807          ?        ? 
1 1 1   23   15    5 o 14.32941 2.828920   9.951116    38.9   2.135122 0.7818757          ?        ? 
1 1 1   23   15    6 o 75.46271 1.016184   92.34836    92.5   56.98671 1.533679          ?        ? 
1 1 1   23   15    7 o 54.09858 1.000578   66.17611   195.4   29.29027 1.082597          ?        ? 
1 1 1   23   15    8 o 46.60614 1.000122   50.27175    23.1   21.74216 0.9322364          ?        ? 
1 1 1   23   15    9 o 73.95679 1.402831   99.91894    15.1   54.82152 2.074978          ?        ? 
1 1 1   23   15   10 o 86.97215 1.296628   108.8620    57.8   75.81188 2.255411          ?        ? 
1 1 1   23   15   11 o 54.19349 1.415003   76.16188     5.8   29.47070 1.533679          ?        ? 
1 1 1   23   15   12 o 10.40881 4.037438   14.80239   153.1  0.7518036 1.202886          ?        ? 
1 1 1   23   15   13 o 10.75675 3.849601   17.72544   266.9   1.052525 1.052525          ?        ? 
1 1 1   23   15   14 o 10.25718 4.289420   18.77542   296.6  0.3608657 1.473535          ?        ? 
1 1 1   23   15   15 o 9.169046 4.058255   14.47316   245.8 -0.2405772 1.473535          ?        ? 
1 1 1   23   15   16 o 11.87646 4.757185   5.202988    88.3   1.112669 1.714112          ?        ? 
1 1 1   23   15   17 o 10.80979 4.187521   10.18488   238.2   1.082597 1.293102          ?        ? 
1 1 1   23   15   18 o 29.53573 2.698128   36.13428   268.9   9.472726 1.593824          ?        ? 
1 1 1   23   16    0 o 14.81633 5.562675   14.59020   360.0   2.977142 1.533679   2.977142 1.533679 
1 1 1   23   16    1 o 48.09897 1.250428   46.10178   275.2   23.15555 1.202886          ?        ? 
1 1 1   23   16    2 o 101.4859 1.244538   137.4640   217.1   103.0873 2.526060          ?        ? 
1 1 1   23   16    3 o 93.81654 1.089843   121.6055   274.1   88.08131 2.044906          ?        ? 
1 1 1   23   16    4 o 41.45598 1.160639   23.46205   234.1   17.20127 0.9623086          ?        ? 
1 1 1   23   16    5 o 50.00033 1.082590   65.66283   312.4   25.02002 1.082597          ?        ? 
1 1 1   23   16    6 o 8.351643 3.297803   14.50690   312.6  0.3909379 0.8119479          ?        ? 
1 1 1   23   16    7 o 16.58832 2.447348   68.47443   309.2   2.766637 0.8119479          ?        ? 
1 1 1   23   16    8 o 65.20176 0.9685553   79.10253   211.6   42.55209 1.263030          ?        ? 
1 1 1   23   16    9 o 35.93777 1.004141   59.05096   309.1   12.93102 0.7217315          ?        ? 
1 1 1   23   16   10 o 42.91935 1.611533   66.07581   297.4   18.49437 1.383319          ?        ? 
1 1 1   23   16   11 o 41.73777 1.729205   56.76379    99.9   17.53206 1.443463          ?        ? 
1 1 1   23   16   12 o 38.13781 1.655876   41.40677   207.0   14.64513 1.263030          ?        ? 
1 1 1   23   16   13 f 45.33155 1.625287   57.27159   334.1   20.71971 1.473535          ?        ? 
1 1 1   23   16   14 o 9.021263 3.968895   7.243593     3.1 -0.2105050 1.383319          ?        ? 
1 1 1   23   16   15 o 14.86075 4.305119   19.00320   348.0   2.495988 1.353247          ?        ? 
1 1 1   23   16   16 o 22.02804 3.344681   21.33108   353.1   5.202481 1.473535          ?        ? 
1 1 1   23   16   17 o 17.71010 3.687538   12.74502   220.3   3.608657 1.263030          ?        ? 
1 1 1   23   16   18 o 12.71220 4.554360   17.28033    50.9   2.014834 1.473535          ?        ? 
1 1 1   23   17    0 o 73.61962 1.738192   94.21533   180.0   54.34037 2.556132   54.34037 2.556132 
1 1 1   23   17    1 o 32.73540 1.699490   26.20128   181.2   10.73576 1.112669          ?        ? 
1 1 1   23   17    2 o 69.31800 1.062881   80.21751   185.0   48.08536 1.473535          ?        ? 
1 1 1   23   17    3 o 61.77599 1.070946   63.36501   122.8   38.19162 1.323174          ?        ? 
1 1 1   23   17    4 o 66.10053 1.046375   77.33508    56.5   43.72490 1.383319          ?        ? 
1 1 1   23   17    5 o 59.26500 1.090949   86.79599   326.9   35.15434 1.293102          ?        ? 
1 1 1   23   17    6 o 63.92241 1.034985   59.90913     1.4   40.89812 1.323174          ?        ? 
1 1 1   23   17    7 o 65.88636 1.026955   78.64882   349.0   43.45425 1.353247          ?        ? 
1 1 1   23   17    8 o 36.79515 1.225928   38.98166   319.1   13.56254 0.9021643          ?        ? 
1 1 1   23   17    9 o 66.74468 0.9236376   92.45859   279.8   44.59699 1.232958          ?        ? 
1 1 1   23   17   10 o 27.40920 2.358884   42.25256   246.3   7.578181 1.293102          ?        ? 
1 1 1   23   17   11 o 52.75972 1.453457   69.59424   164.3   27.96709 1.533679          ?        ? 
1 1 1   23   17   12 o 21.19998 2.907923   37.54096   226.3   4.601038 1.232958          ?        ? 
1 1 1   23   17   13 o 37.78185 1.790869   52.45963   178.4   14.43463 1.353247          ?        ? 
1 1 1   23   17   14 o 18.35042 4.116814   19.99957   204.4   3.759018 1.473535          ?        ? 
1 1 1   23   17   15 f 36.53749 1.934165   48.98576    41.9   13.65275 1.413391          ?        ? 
1 1 1   23   17   16 o 7.515380 3.581330   9.908999   160.4  -1.533679 1.473535          ?        ? 
1 1 1   23   17   17 o 10.33723 4.163408   6.509505   170.7  0.8720922 1.323174          ?        ? 
1 1 1   23   17   18 o 14.87759 4.649229   11.52415    66.9   2.947070 1.533679          ?        ? 
1 1 1   23   18    0 o 18.00313 5.292764   23.94590   180.0   3.999595 1.653968   3.999595 1.653968 
1 1 1   23   18    1 o 31.90331 1.555295   59.12789   356.6   10.19446 0.9923807          ?        ? 
1 1 1   23   18    2 o 32.96941 1.505002   51.88203   119.0   10.88612 0.9923807          ?        ? 
1 1 1   23   18    3 o 100.6996 1.134802   134.1927   252.1   101.4935 2.285483          ?        ? 
1 1 1   23   18    4 o 33.41938 1.484739   55.22490   233.4   11.18684 0.9923807          ?        ? 
1 1 1   23   18    5 o 65.15389 1.084656   95.35944     1.3   42.49194 1.413391          ?        ? 
1 1 1   23   18    6 o 113.9518 1.108390   142.3721    87.8   130.0019 2.526060          ?        ? 
1 1 1   23   18    7 o 26.93783 1.674530   30.75082   304.3   7.277459 0.9021643          ?        ? 
1 1 1   23   18    8 o 26.14101 1.668054   41.31700   345.3   6.856449 0.8720922          ?        ? 
1 1 1   23   18    9 o 29.94678 1.305442   36.43540    34.0   8.991571 0.7818757          ?        ? 
1 1 1   23   18   10 o 34.38641 1.005716   41.52646    70.2   11.84843 0.6916593          ?        ? 
1 1 1   23   18   11 o 21.08807 2.994656   40.94532   200.1   4.540894 1.263030          ?        ? 
1 1 1   23   18   12 o 9.321443 3.826483   8.139347   260.5  0.3608657 1.142741          ?        ? 
1 1 1   23   18   13 o 20.15730 3.132935   30.18558    61.8   4.210100 1.263030          ?        ? 
1 1 1   23   18   14 o 11.73121 4.521497   9.198418   295.5   1.172814 1.503607          ?        ? 
1 1 1   23   18   15 o 13.82191 4.318205   20.28783    47.2   2.165194 1.323174          ?        ? 
1 1 1   23   18   16 o 34.43438 2.314292   45.98074   173.6   12.35965 1.593824          ?        ? 
1 1 1   23   18   17 o 10.96541 4.455664   10.23979   293.7   1.082597 1.533679          ?        ? 
1 1 1   23   19    0 f 11.61392 5.705413   3.392871   180.0   2.014834 1.563751   2.014834 1.563751 
1 1 1   23   19    1 o 8.877876 3.524769   18.79070    63.6  0.4210100 0.9322364          ?        ? 
1 1 1   23   19    2 o 44.39161 1.219371   43.70090   316.6   19.72733 1.082597          ?        ? 
1 1 1   23   19    3 o 50.91870 1.122124   94.08183   267.0   25.95226 1.142741          ?        ? 
1 1 1   23   19    4 o 42.23839 1.210336   73.50438   240.9   17.86285 1.022453          ?        ? 
1 1 1   23   19    5 o 49.62531 1.181669   67.64889   324.2   24.65916 1.172814          ?        ? 
1 1 1   23   19    6 o 25.73812 1.811003   30.97087    19.4   6.645944 0.9322364          ?        ? 
1 1 1   23   19    7 o 51.31594 1.113437   60.36753   239.6   26.37327 1.142741          ?        ? 
1 1 1   23   19    8 f 6.156223 2.814152   28.92653    27.4 -0.5412986 0.7818757          ?        ? 
1 1 1   23   19    9 o 29.53500 1.425462   40.59715   355.5   8.750995 0.8420200          ?        ? 
1 1 1   23   19   10 o 13.08590 2.731920   15.48369   182.8   1.804329 0.6916593          ?        ? 
1 1 1   23   19   11 o 39.24850 1.647327   50.60603   204.4   15.51723 1.293102          ?        ? 
1 1 1   23   19   12 o 19.90072 3.173327   25.17735   202.7   4.089812 1.263030          ?        ? 
1 1 1   23   19   13 o 9.619936 3.993719   1.790289   144.6  0.3608657 1.263030          ?        ? 
1 1 1   23   19   14 o 14.36600 4.158281   14.73148    46.2   2.315555 1.263030          ?        ? 
1 1 1   23   19   15 o 24.39918 2.834764   28.42837   262.0   6.255006 1.383319          ?        ? 
1 1 1   23   19   16 o 13.28997 4.336609   15.81886   100.8   2.074978 1.323174          ?        ? 
1 1 1   23   19   17 o 26.01047 3.063812   33.79582   288.0   7.518036 1.593824          ?        ? 
1 1 1   23   20    0 o 27.57499 2.378563   17.86912   360.0   7.788685 1.293102   7.788685 1.293102 
1 1 1   23   20    1 o 62.90105 1.123503   62.83040     5.2   39.60501 1.413391          ?        ? 
1 1 1   23   20    2 o 90.99047 1.123693   104.8901   292.5   82.87883 2.044906          ?        ? 
1 1 1   23   20    3 o 70.82974 1.082652   86.75121   348.9   50.22048 1.533679          ?        ? 
1 1 1   23   20    4 o 50.31871 1.135504   48.60411     1.0   25.35082 1.142741          ?        ? 
1 1 1   23   20    5 o 46.14013 1.238338   54.43136    40.5   21.32115 1.142741          ?        ? 
1 1 1   23   20    6 o 20.01336 2.253906   48.75981    94.5   4.029667 0.9021643          ?        ? 
1 1 1   23   20    7 o 25.43445 1.832626   42.64935   131.4   6.495584 0.9322364          ?        ? 
1 1 1   23   20    8 o 38.84680 1.238594   31.79772   266.6   15.12629 0.9623086          ?        ? 
1 1 1   23   20    9 f 27.01501 1.614088   39.74907   116.2   7.337603 0.8720922          ?        ? 
1 1 1   23   20   10 o 17.50561 2.147322   28.12816    46.1   3.097431 0.7518036          ?        ? 
1 1 1   23   20   11 o 18.11557 1.660017   29.68166   212.0   3.307936 0.6014429          ?        ? 
1 1 1   23   20   12 o 11.13524 4.254846   23.12201   164.0  0.9923807 1.323174          ?        ? 
1 1 1   23   20   13 o 40.47918 1.745824   42.35934   236.6   16.62990 1.413391          ?        ? 
1 1 1   23   20   14 o 8.220939 3.631890   11.88550   231.1 -0.1804329 1.172814          ?        ? 
1 1 1   23   20   15 o 16.95930 4.524992   15.81270   211.6   3.398152 1.563751          ?        ? 
1 1 1   23   20   16 o 14.50998 4.714388   21.09087    20.2   2.586205 1.563751          ?        ? 
1 1 1   23   20   17 o 12.89329 4.560827   21.60780   244.9   2.105050 1.473535          ?        ? 
1 1 1   23   21    0 o 53.66959 1.487373   49.74563     0.0   28.89933 1.593824   28.89933 1.593824 
1 1 1   23   21    1 o 86.70245 0.9885027   111.3944   185.6   75.24050 1.714112          ?        ? 
1 1 1   23   21    2 o 87.98358 1.076647   106.1187   124.2   77.49592 1.894545          ?        ? 
1 1 1   23   21    3 o 51.08429 1.206788   74.81174   324.5   26.13269 1.232958          ?        ? 
1 1 1   23   21    4 o 67.08066 1.053501   81.52441   350.6   45.04807 1.413391          ?        ? 
1 1 1   23   21    5 o 41.28199 1.384068   58.01487    99.5   17.08098 1.142741          ?        ? 
1 1 1   23   21    6 o 71.89135 1.066665   120.7112   188.8   51.75416 1.533679          ?        ? 
1 1 1   23   21    7 o 51.91559 1.129539   61.59649   196.6   27.00479 1.172814          ?        ? 
1 1 1   23   21    8 o 8.342943 3.408183   10.11268   293.5  0.2706493 0.9021643          ?        ? 
1 1 1   23   21    9 o 44.10780 1.193128   57.89449    51.9   19.51682 1.052525          ?        ? 
1 1 1   23   21   10 o 21.28289 1.836865   20.75546    92.5   4.570966 0.7818757          ?        ? 
1 1 1   23   21   11 o 43.20918 1.043950   48.11878    41.0   18.73495 0.9021643          ?        ? 
1 1 1   23   21   12 o 22.40803 1.274924   21.78234   172.2   5.052120 0.5713707          ?        ? 
1 1 1   23   21   13 f 9.764484 4.018028   12.18016    54.1  0.4811543 1.263030          ?        ? 
1 1 1   23   21   14 o 34.73174 1.991433   42.31727   141.9   12.35965 1.383319          ?        ? 
1 1 1   23   21   15 o 8.518949 3.913859   13.46959   195.1 -0.7217315 1.533679          ?        ? 
1 1 1   23   21   16 o 16.43690 4.524738   16.47657   212.7   3.398152 1.533679          ?        ? 
1 1 1   23   22    0 o 70.76276 1.467557   67.16088   180.0   50.19041 2.074978   50.19041 2.074978 
1 1 1   23   22    1 o 34.60677 1.390347   52.90821    81.6   11.99879 0.9623086          ?        ? 
1 1 1   23   22    2 o 22.81799 2.240453   33.30721   197.0   5.232553 1.022453          ?        ? 
1 1 1   23   22    3 o 53.70766 1.315819   45.17269   145.7   28.89933 1.413391          ?        ? 
1 1 1   23   22    4 o 11.24568 4.059735   16.06644   269.5   1.082597 1.172814          ?        ? 
1 1 1   23   22    5 o 66.54116 1.220219   82.63219   120.6   44.35641 1.623896          ?        ? 
1 1 1   23   22    6 o 35.29288 1.704148   47.82795   239.8   12.51001 1.202886          ?        ? 
1 1 1   23   22    7 o 48.00990 1.440660   39.19445    69.7   23.12548 1.383319          ?        ? 
1 1 1   23   22    8 o 78.80255 1.240245   91.48727   356.5   62.30948 1.954689          ?        ? 
1 1 1   23   22    9 o 42.71693 1.478372   55.60617    37.9   18.34401 1.263030          ?        ? 
1 1 1   23   22   10 o 5.878093 2.851918   4.436097    30.7  -1.744184 1.052525          ?        ? 
1 1 1   23   22   11 o 42.57859 1.377234   55.72768    38.1   18.25379 1.172814          ?        ? 
1 1 1   23   22   12 o 54.67756 0.9074845   60.33661   357.9   30.01200 0.9923807          ?        ? 
1 1 1   23   22   13 o 11.73170 4.260113   19.82634   117.8   1.353247 1.293102          ?        ? 
1 1 1   23   22   14 o 16.43011 3.897440   21.25451   194.4   3.067359 1.263030          ?        ? 
1 1 1   23   22   15 o 22.97830 3.468107   26.93332   241.3   5.833996 1.593824          ?        ? 
1 1 1   23   22   16 o 15.68016 4.760968   10.64810   256.0   3.247792 1.623896          ?        ? 
1 1 1   23   23    0 o 22.57810 4.860347   28.25367   360.0   5.803924 1.924617   5.803924 1.924617 
1 1 1   23   23    1 o 45.33954 1.326531   75.24722    56.8   20.59942 1.202886          ?        ? 
1 1 1   23   23    2 o 19.60976 2.683677   15.23634   100.3   3.879307 1.052525          ?        ? 
1 1 1   23   23    3 o 20.42208 2.797810   9.978498   266.6   4.210100 1.142741          ?        ? 
1 1 1   23   23    4 o 16.62619 3.627430   17.55148   295.0   2.916998 1.172814          ?        ? 
1 1 1   23   23    5 o 42.32818 1.562995   35.72306   299.5   17.98314 1.323174          ?        ? 
1 1 1   23   23    6 o 49.55246 1.395813   56.56140   134.7   24.62909 1.383319          ?        ? 
1 1 1   23   23    7 f 9.273643 3.786113   27.49018   294.7  0.3608657 1.112669          ?        ? 
1 1 1   23   23    8 o 9.461338 3.814887   11.26507   290.2  0.4510822 1.112669          ?        ? 
1 1 1   23   23    9 o 42.73365 1.477793   49.10878   180.9   18.37408 1.263030          ?        ? 
1 1 1   23   23   10 o 13.85193 3.719839   11.26679   260.9   2.074978 1.052525          ?        ? 
1 1 1   23   23   11 o 43.30649 1.354085   35.96762   274.4   18.88531 1.172814          ?        ? 
1 1 1   23   23   12 o 36.27959 1.533465   39.08630    44.1   13.32196 1.112669          ?        ? 
1 1 1   23   23   13 f 35.12099 1.369991   34.13644   113.5   12.47994 0.9623086          ?        ? 
1 1 1   23   23   14 o 11.44668 4.205007   6.487825   277.6   1.323174 1.263030          ?        ? 
1 1 1   23   23   15 o 10.12530 4.417240   11.50166   155.9  0.3007214 1.684040          ?        ? 
1 1 1   23   23   16 o 16.23252 4.832301   28.60836   266.2   3.548513 1.684040          ?        ? 
1 1 1   23   24    0 f 55.28396 1.881429   66.40964    -0.0   30.73373 2.074978   30.73373 2.074978 
1 1 1   23   24    1 o 19.66723 2.981644   14.79919   343.5   3.909379 1.172814          ?        ? 
1 1 1   23   24    2 o 15.90829 3.744176   21.69649   269.6   2.676421 1.172814          ?        ? 
1 1 1   23   24    3 o 24.13009 2.243251   23.82973   327.0   5.864068 1.082597          ?        ? 
1 1 1   23   24    4 f 87.57778 1.287662   101.9597   286.0   76.89447 2.255411          ?        ? 
1 1 1   23   24    5 o 9.798940 3.960114   18.29658    68.3  0.4510822 1.202886          ?        ? 
1 1 1   23   24    6 o 37.32059 1.692136   49.99916   231.2   14.01362 1.263030          ?        ? 
1 1 1   23   24    7 o 27.60556 2.124234   42.77468   272.5   7.698469 1.172814          ?        ? 
1 1 1   23   24    8 o 28.48167 2.111684   49.00766   124.2   8.209695 1.202886          ?        ? 
1 1 1   23   24    9 o 25.50702 2.357950   29.99124   204.9   6.615872 1.202886          ?        ? 
1 1 1   23   24   10 o 10.65869 3.745631   14.38469   296.4   1.082597 0.9923807          ?        ? 
1 1 1   23   24   11 o 7.000284 3.244196   6.562293    78.1 -0.8119479 1.082597          ?        ? 
1 1 1   23   24   12 o 23.17034 2.336170   32.69145    68.0   5.533275 1.082597          ?        ? 
1 1 1   23   24   13 o 11.05839 3.698270   21.12706   172.9   1.293102 0.9623086          ?        ? 
1 1 1   23   24   14 o 15.89385 2.365077   11.26076    98.8   2.646349 0.7518036          ?        ? 
1 1 1   23   24   15 o 13.75243 4.714285   21.97925   124.4   2.405771 1.563751          ?        ? 
1 1 1   23   25    0 o 21.19597 4.523817   51.11674   180.0   5.112265 1.684040   5.112265 1.684040 
1 1 1   23   25    1 o 56.53589 1.382972   65.53941   257.7   32.05691 1.563751          ?        ? 
1 1 1   23   25    2 o 61.00364 1.355631   69.94220   338.6   37.31953 1.653968          ?        ? 
1 1 1   23   25    3 o 18.63039 2.986167   40.27402   215.2   3.518441 1.112669          ?        ? 
1 1 1   23   25    4 o 19.57728 2.611326   14.94542   341.6   3.879307 1.022453          ?        ? 
1 1 1   23   25    5 o 38.58038 1.675855   44.86860    34.1   14.97593 1.293102          ?        ? 
1 1 1   23   25    6 o 27.27680 2.149837   18.86280   359.8   7.518036 1.172814          ?        ? 
1 1 1   23   25    7 o 37.72204 1.753848   58.77193   247.1   14.34441 1.323174          ?        ? 
1 1 1   23   25    8 o 16.22135 3.528116   11.38186   192.3   2.826782 1.112669          ?        ? 
1 1 1   23   25    9 o 21.30621 2.752282   19.15796   226.2   4.661182 1.172814          ?        ? 
1 1 1   23   25   10 o 9.559823 3.861341   13.20421   270.4  0.5112265 1.142741          ?        ? 
1 1 1   23   25   11 o 9.491195 3.713919   8.580151   331.6  0.6615872 1.022453          ?        ? 
1 1 1   23   25   12 o 9.798162 3.863185   14.37439    74.4  0.7217315 1.112669          ?        ? 
1 1 1   23   25   13 o 19.44645 2.628894   15.38147    60.8   3.969523 1.022453          ?        ? 
1 1 1   23   25   14 o 12.64564 3.465576   16.65845   281.1   1.834401 0.9021643          ?        ? 
1 1 1   23   25   15 o 17.79997 2.280756   16.34317   308.5   3.368080 0.8119479          ?        ? 
1 1 1   23   26    0 o 48.27079 2.095523   40.17742   360.0   23.51642 2.014834   23.51642 2.014834 
1 1 1   23   26    1 o 36.75729 1.881693   74.37952   265.7   13.59261 1.383319          ?        ? 
1 1 1   23   26    2 o 28.47543 2.164951   42.53362     0.8   8.179624 1.232958          ?        ? 
1 1 1   23   26    3 o 18.04584 3.627110   25.42328   164.9   3.458297 1.263030          ?        ? 
1 1 1   23   26    4 o 42.81097 1.615613   59.98547   327.7   18.43423 1.383319          ?        ? 
1 1 1   23   26    5 o 44.21024 1.428436   52.91105   322.0   19.63711 1.263030          ?        ? 
1 1 1   23   26    6 o 40.82851 1.583577   31.43650    65.7   16.78026 1.293102          ?        ? 
1 1 1   23   26    7 o 18.28112 3.331081   16.35664   140.4   3.548513 1.172814          ?        ? 
1 1 1   23   26    8 o 23.85791 2.710007   35.17206   119.6   5.833996 1.293102          ?        ? 
1 1 1   23   26    9 o 24.02337 2.378396   18.15532   261.8   5.894140 1.142741          ?        ? 
1 1 1   23   26   10 o 15.62522 3.707650   15.62337   234.5   2.706493 1.142741          ?        ? 
1 1 1   23   26   11 o 27.26493 2.150773   36.07310   320.3   7.638325 1.172814          ?        ? 
1 1 1   23   26   12 o 16.82210 3.760092   10.29045    59.7   3.187647 1.232958          ?        ? 
1 1 1   23   26   13 o 19.33185 2.877814   23.89998    57.6   3.999595 1.112669          ?        ? 
1 1 1   23   26   14 f 19.08545 2.599836   20.55573   285.7   3.909379 0.9923807          ?        ? 
1 1 1   23   26   15 o 7.969984 3.240808   10.33069   263.9  0.4510822 0.8119479          ?        ? 
1 1 1   23   27    0 o 12.78382 5.908856   19.29850   180.0   2.465916 1.653968   2.465916 1.653968 
1 1 1   23   27    1 o 27.53140 2.293799   36.60264    23.3   7.668397 1.263030          ?        ? 
1 1 1   23   27    2 o 20.24685 2.970551   6.778798   321.3   4.180028 1.202886          ?        ? 
1 1 1   23   27    3 o 77.03194 1.229714   88.90183   225.8   59.54285 1.894545          ?        ? 
1 1 1   23   27    4 o 22.79485 2.770428   21.37965   236.6   5.292697 1.263030          ?        ? 
1 1 1   23   27    5 o 21.49843 2.797613   16.65846    12.9   4.721327 1.202886          ?        ? 
1 1 1   23   27    6 o 38.06481 1.501047   29.03680   101.5   14.58499 1.142741          ?        ? 
1 1 1   23   27    7 o 32.40159 2.041836   37.38467    39.9   10.64554 1.323174          ?        ? 
1 1 1   23   27    8 o 20.55844 2.925528   23.44475   134.9   4.360461 1.202886          ?        ? 
1 1 1   23   27    9 o 14.42423 4.020968   6.463511   227.2   2.315555 1.202886          ?        ? 
1 1 1   23   27   10 o 11.94520 4.130829   10.50067    98.4   1.473535 1.202886          ?        ? 
1 1 1   23   27   11 o 14.95656 3.808972   17.21044   315.5   2.526060 1.142741          ?        ? 
1 1 1   23   27   12 o 17.20388 3.442779   12.04881   138.8   3.307936 1.142741          ?        ? 
1 1 1   23   27   13 o 24.28370 2.352899   17.29811   189.2   6.194862 1.142741          ?        ? 
1 1 1   23   27   14 o 7.379814 3.354754   10.94685   128.7 -0.3307936 1.082597          ?        ? 
1 1 1   23   28    0 o 33.75078 2.799395   51.87078   180.0   11.72814 1.864473   11.72814 1.864473 
1 1 1   23   28    1 o 23.43643 2.758744   14.99973   145.1   5.593419 1.293102          ?        ? 
1 1 1   23   28    2 f 72.16428 1.291825   86.77807   180.6   52.29546 1.864473          ?        ? 
1 1 1   23   28    3 o 13.91507 3.932236   32.08640    55.6   2.074978 1.142741          ?        ? 
1 1 1   23   28    4 o 46.24147 1.560788   52.19447   271.7   21.53165 1.443463          ?        ? 
1 1 1   23   28    5 o 7.240021 3.423290   11.37751   231.3  -1.473535 1.323174          ?        ? 
1 1 1   23   28    6 o 34.86595 1.854391   46.32100   183.0   12.29951 1.293102          ?        ? 
1 1 1   23   28    7 o 26.15011 2.069967   25.51220   120.3   6.946666 1.082597          ?        ? 
1 1 1   23   28    8 o 9.022355 3.649075   16.43429    16.8  0.4510822 1.022453          ?        ? 
1 1 1   23   28    9 o 34.98779 1.933884   42.81818    75.7   12.47994 1.353247          ?        ? 
1 1 1   23   28   10 o 11.46214 4.114064   11.13045   162.1   1.323174 1.202886          ?        ? 
1 1 1   23   28   11 o 19.56474 2.997264   22.37074   175.6   4.059740 1.172814          ?        ? 
1 1 1   23   28   12 o 7.980652 3.569765   16.73335    13.2 -0.2405772 1.172814          ?        ? 
1 1 1   23   28   13 o 23.06828 2.672410   19.70352   334.2   5.743780 1.232958          ?        ? 
1 1 1   23   28   14 o 12.79223 4.016292   9.859599   268.9   2.044906 1.142741          ?        ? 
1 1 1   23   29    0 o 13.68660 6.418321   11.13386   180.0   2.886926 1.954689   2.886926 1.954689 
1 1 1   23   29    1 o 54.34116 1.466498   52.21963   125.7   29.71128 1.593824          ?        ? 
1 1 1   23   29    2 o 39.19991 1.841156   55.09153   185.9   15.51723 1.443463          ?        ? 
1 1 1   23   29    3 f 45.16679 1.664505   35.28691   180.1   20.56935 1.503607          ?        ? 
1 1 1   23   29    4 o 45.67239 1.547314   57.95122   122.5   21.02043 1.413391          ?        ? 
1 1 1   23   29    5 o 28.77039 2.195018   35.48237   317.6   8.420200 1.263030          ?        ? 
1 1 1   23   29    6 o 46.35475 1.556974   58.97990   320.1   21.68202 1.443463          ?        ? 
1 1 1   23   29    7 o 30.49302 2.169635   25.40625   335.7   9.502798 1.323174          ?        ? 
1 1 1   23   29    8 o 26.89001 2.292594   28.84637   344.7   7.427820 1.232958          ?        ? 
1 1 1   23   29    9 o 12.48459 4.027734   13.74243   330.6   1.714112 1.142741          ?        ? 
1 1 1   23   29   10 f 16.75131 3.924359   22.71961   155.0   3.187647 1.293102          ?        ? 
1 1 1   23   29   11 o 17.43673 3.486292   24.35880    72.6   3.428224 1.172814          ?        ? 
1 1 1   23   29   12 o 35.91055 1.926062   31.10040   226.7   13.35203 1.383319          ?        ? 
1 1 1   23   29   13 o 12.98408 4.236904   17.85472   160.7   2.105050 1.263030          ?        ? 
1 1 1   23   30    0 o 14.71795 6.153615   2.193181   360.0   3.187647 1.804329   3.187647 1.804329 
1 1 1   23   30    1 o 49.77596 1.510375   50.69162    49.2   24.95988 1.503607          ?        ? 
1 1 1   23   30    2 o 28.19298 2.293306   44.70711   101.0   8.089407 1.293102          ?        ? 
1 1 1   23   30    3 o 52.00834 1.532277   58.53595     6.7   27.27543 1.593824          ?        ? 
1 1 1   23   30    4 o 15.42404 4.114567   5.188985   154.8   2.616277 1.293102          ?        ? 
1 1 1   23   30    5 o 27.32374 2.421291   26.35669   311.3   7.638325 1.323174          ?        ? 
1 1 1   23   30    6 o 18.76822 3.410582   18.95842    73.0   3.819162 1.232958          ?        ? 
1 1 1   23   30    7 o 21.34025 2.888809   23.98146    31.2   4.751399 1.232958          ?        ? 
1 1 1   23   30    8 o 41.00851 1.686624   42.74404   175.5   17.11105 1.383319          ?        ? 
1 1 1   23   30    9 o 15.25668 3.683020   5.506647   308.9   2.616277 1.112669          ?        ? 
1 1 1   23   30   10 o 12.52102 3.967872   5.353724   153.6   1.774257 1.112669          ?        ? 
1 1 1   23   30   11 o 14.28926 4.165479   17.76914   136.0   2.435844 1.263030          ?        ? 
1 1 1   23   30   12 o 32.75981 1.835917   34.35212   138.2   11.15676 1.202886          ?        ? 
1 1 1   23   31    0 o 18.04933 5.859846   31.28780     0.0   4.300317 1.864473   4.300317 1.864473 
1 1 1   23   31    1 o 12.82801 4.336613   22.96637   184.3   1.684040 1.323174          ?        ? 
1 1 1   23   31    2 o 24.81794 2.605177   17.53538   254.9   6.315150 1.293102          ?        ? 
1 1 1   23   31    3 o 24.23116 2.730316   29.53518   152.0   6.044501 1.323174          ?        ? 
1 1 1   23   31    4 o 27.20107 2.487488   43.85794   166.5   7.608253 1.353247          ?        ? 
1 1 1   23   31    5 f 15.92982 4.122447   13.08185    44.2   2.856854 1.323174          ?        ? 
1 1 1   23   31    6 o 17.80358 3.985082   21.60219     4.5   3.548513 1.383319          ?        ? 
1 1 1   23   31    7 o 22.61994 2.725379   30.30432   105.7   5.352841 1.232958          ?        ? 
1 1 1   23   31    8 o 20.90437 3.092900   14.99078    17.8   4.631110 1.293102          ?        ? 
1 1 1   23   31    9 o 20.34638 2.882118   26.38615   291.6   4.390533 1.172814          ?        ? 
1 1 1   23   31   10 o 32.11473 1.825975   36.12356    53.5   10.61547 1.172814          ?        ? 
1 1 1   23   31   11 o 10.14421 3.935125   8.532459   338.4  0.9923807 1.142741          ?        ? 
1 1 1   23   31   12 o 9.755356 3.857839   17.38345    15.0  0.9021643 1.112669          ?        ? 
1 1 1   23   32    0 o 9.489260 5.693586   14.77448   180.0   1.172814 1.894545   1.172814 1.894545 
1 1 1   23   32    1 o 24.77640 2.670232   31.98243   275.4   6.345222 1.323174          ?        ? 
1 1 1   23   32    2 o 13.99093 4.366197   6.204785    98.7   2.165194 1.353247          ?        ? 
1 1 1   23   32    3 o 10.42217 4.293201   15.73577   281.1  0.5713707 1.443463          ?        ? 
1 1 1   23   32    4 o 8.228529 3.711697   8.052975   167.0 -0.4811543 1.293102          ?        ? 
1 1 1   23   32    5 o 51.70977 1.541124   69.11190   209.0   27.09500 1.593824          ?        ? 
1 1 1   23   32    6 o 8.265422 3.740049   11.27510   186.6 -0.4811543 1.323174          ?        ? 
1 1 1   23   32    7 o 13.21697 4.231463   18.40137   310.3   1.954689 1.263030          ?        ? 
1 1 1   23   32    8 o 26.55210 2.604914   19.34923   219.5   7.397748 1.383319          ?        ? 
1 1 1   23   32    9 o 13.92204 4.425472   16.30086   284.5   2.315555 1.383319          ?        ? 
1 1 1   23   32   10 o 12.45602 4.082784   13.80314    18.3   1.834401 1.172814          ?        ? 
1 1 1   23   32   11 o 6.542256 3.136089   10.71545   171.9  -1.263030 1.172814          ?        ? 
1 1 1   23   33    0 o 14.27206 6.571606   23.30589     0.0   3.247792 2.044906   3.247792 2.044906 
1 1 1   23   33    1 o 42.15624 1.890377   44.11772   317.6   18.10343 1.593824          ?        ? 
1 1 1   23   33    2 o 25.45779 2.716887   22.57672   262.2   6.736160 1.383319          ?        ? 
1 1 1   23   33    3 o 24.28361 2.972093   25.20154   329.0   6.194862 1.443463          ?        ? 
1 1 1   23   33    4 o 43.67284 1.721444   52.99344   239.4   19.42661 1.503607          ?        ? 
1 1 1   23   33    5 o 19.03347 3.686479   21.42253   124.1   4.029667 1.353247          ?        ? 
1 1 1   23   33    6 o 15.40839 4.185654   16.13449   309.3   2.736565 1.323174          ?        ? 
1 1 1   23   33    7 o 29.51107 2.292778   31.34555   338.5   9.051716 1.353247          ?        ? 
1 1 1   23   33    8 o 15.94945 4.045866   9.195059   327.7   3.007215 1.293102          ?        ? 
1 1 1   23   33    9 o 19.71531 3.720469   22.09335   310.8   4.510822 1.413391          ?        ? 
1 1 1   23   33   10 o 14.54441 4.141716   14.21371   347.1   2.646349 1.263030          ?        ? 
1 1 1   23   34    0 o 13.73487 6.229599   6.927200   180.0   3.007215 1.834401   3.007215 1.834401 
1 1 1   23   34    1 o 29.89115 2.414532   26.01810   128.0   9.262220 1.443463          ?        ? 
1 1 1   23   34    2 o 13.45223 4.482006   18.17805   320.3   2.014834 1.413391          ?        ? 
1 1 1   23   34    3 o 11.79502 4.306784   8.942822   283.0   1.383319 1.323174          ?        ? 
1 1 1   23   34    4 o 37.47216 1.926047   32.05917    44.8   14.37449 1.443463          ?        ? 
1 1 1   23   34    5 o 35.87555 2.011764   35.84665   302.7   13.23174 1.443463          ?        ? 
1 1 1   23   34    6 f 17.15658 4.011535   15.05725    47.4   3.428224 1.353247          ?        ? 
1 1 1   23   34    7 o 26.66144 2.650628   30.42012   219.4   7.548109 1.413391          ?        ? 
1 1 1   23   34    8 o 11.18335 4.260194   9.210163   267.7   1.293102 1.323174          ?        ? 
1 1 1   23   34    9 o 10.47774 4.186829   17.39850   324.1   1.052525 1.323174          ?        ? 
1 1 1   23   35    0 o 14.71550 6.379097   25.35521   180.0   3.398152 1.924617   3.398152 1.924617 
1 1 1   23   35    1 o 25.96385 2.953490   31.92650   137.7   7.127099 1.533679          ?        ? 
1 1 1   23   35    2 o 18.21902 4.137346   23.23638     6.1   3.819162 1.473535          ?        ? 
1 1 1   23   35    3 o 24.25442 3.099656   31.88997    50.0   6.285078 1.503607          ?        ? 
1 1 1   23   35    4 o 21.73083 3.252040   20.23904   135.0   5.112265 1.413391          ?        ? 
1 1 1   23   35    5 o 10.00547 4.241681   11.96275    76.0  0.4811543 1.473535          ?        ? 
1 1 1   23   35    6 o 9.692789 4.156423   8.420012   352.1  0.3608657 1.443463          ?        ? 
1 1 1   23   35    7 o 10.75977 4.286819   12.74002   151.5   1.082597 1.383319          ?        ? 
1 1 1   23   35    8 o 9.558998 4.082969   15.35598   296.9  0.5112265 1.383319          ?        ? 
1 1 1   23   36    0 o 5.265394 3.812519   11.30133   360.0  -2.826782 1.924617  -2.826782 1.924617 
1 1 1   23   36    1 o 12.90881 4.644228   6.496791    53.7   1.864473 1.533679          ?        ? 
1 1 1   23   36    2 o 10.83014 4.380494   9.244611   343.5  0.9322364 1.473535          ?        ? 
1 1 1   23   36    3 f 11.81278 4.390410   14.88342    95.5   1.473535 1.383319          ?        ? 
1 1 1   23   36    4 o 31.63305 2.471706   32.07536   186.3   10.55532 1.563751          ?        ? 
1 1 1   23   36    5 o 10.85822 4.411879   8.572755   225.8  0.9923807 1.503607          ?        ? 
1 1 1   23   36    6 o 14.13906 4.239581   11.59471   356.9   2.495988 1.293102          ?        ? 
1 1 1   23   36    7 o 10.89831 4.233019   12.87564    60.3   1.263030 1.323174          ?        ? 
1 1 1   23   37    0 o 19.31259 5.815638   13.35190    -0.0   5.052120 1.954689   5.052120 1.954689 
1 1 1   23   37    1 o 28.76698 2.717963   24.91007   289.1   8.841210 1.563751          ?        ? 
1 1 1   23   37    2 o 13.06943 4.649961   15.02774   301.0   2.014834 1.533679          ?        ? 
1 1 1   23   37    3 o 17.52250 4.451720   19.63843    22.2   3.819162 1.563751          ?        ? 
1 1 1   23   37    4 f 16.98235 4.394410   28.36819     6.8   3.638730 1.503607          ?        ? 
1 1 1   23   37    5 o 19.13342 4.053094   17.74951   257.8   4.480750 1.503607          ?        ? 
1 1 1   23   37    6 o 20.03887 3.890568   14.55683   149.7   4.871688 1.503607          ?        ? 
1 1 1   23   38    0 o 9.719714 5.829497   12.25078   360.0   1.593824 1.984761   1.593824 1.984761 
1 1 1   23   38    1 o 11.19384 4.572639   18.11114   218.6   1.202886 1.623896          ?        ? 
1 1 1   23   38    2 o 34.71770 2.338715   32.78919   290.1   12.84081 1.623896          ?        ? 
1 1 1   23   38    3 o 7.417212 3.537096   8.772540   145.4  -1.263030 1.443463          ?        ? 
1 1 1   23   38    4 o 13.33469 4.659245   16.10403    51.0   2.315555 1.533679          ?        ? 
1 1 1   23   39    0 o 31.43934 3.824166   30.55786   180.0   11.21691 2.345627   11.21691 2.345627 
1 1 1   23   39    1 o 16.39464 4.762727   18.97059   186.1   3.638730 1.653968          ?        ? 
1 1 1   24    0    0 o 136.0230 2.245343   230.3885   180.0   185.2745 6.104645   185.2745 6.104645 
1 1 1   24    0    1 o 62.90879 1.243957   64.71637   180.0   39.63509 1.563751   39.63509 1.563751 
1 1 1   24    0    2 o 20.88015 2.432347   69.61098     0.0   4.540894 0.9923807   4.540894 0.9923807 
1 1 1   24    0    3 o 91.40226 1.316647   106.1114     0.0   83.63064 2.405771   83.63064 2.405771 
1 1 1   24    0    4 o 33.25616 1.727964   44.85905   180.0   11.15676 1.142741   11.15676 1.142741 
1 1 1   24    0    5 o 8.451417 4.407940   14.43958   180.0   1.052525 0.9623086   1.052525 0.9623086 
1 1 1   24    0    6 o 56.19084 1.259076   96.39823   180.0   31.63589 1.413391   31.63589 1.413391 
1 1 1   24    0    7 o 41.36166 1.348194   50.27150     0.0   17.17119 1.112669   17.17119 1.112669 
1 1 1   24    0    8 o 120.5089 1.497776   183.7157   180.0   145.3988 3.608657   145.3988 3.608657 
1 1 1   24    0    9 o 61.39539 1.029250   71.95125     0.0   37.74054 1.263030   37.74054 1.263030 
1 1 1   24    0   10 o 26.57057 1.712255   32.31664   180.0   7.157170 0.9021643   7.157170 0.9021643 
1 1 1   24    0   11 x        ?      ?   28.97194   180.0          ?        ?          ?        ? 
1 1 1   24    0   12 x        ?      ?   31.72033   180.0          ?        ?          ?        ? 
1 1 1   24    0   13 o 32.56081 4.173984   37.44086   180.0   11.30713 2.646349   11.30713 2.646349 
1 1 1   24    0   14 x        ?      ?   78.85201   180.0          ?        ?          ?        ? 
1 1 1   24    0   15 x        ?      ?   2.916831     0.0          ?        ?          ?        ? 
1 1 1   24    0   16 x        ?      ?   43.68414   180.0          ?        ?          ?        ? 
1 1 1   24    0   17 x        ?      ?   20.99223   180.0          ?        ?          ?        ? 
1 1 1   24    0   18 o 12.99172 7.413868   11.47097     0.0   3.127503 2.977142   3.127503 2.977142 
1 1 1   24    0   19 o 7.956575 5.495537  0.1239957     0.0 -0.6615872 2.766637 -0.6615872 2.766637 
1 1 1   24    1    0 o 9.223776 4.542804   3.346481   360.0   1.263030 0.9923807   1.263030 0.9923807 
1 1 1   24    1    1 o 10.26333 3.185757   1.776613   111.2   1.052525 0.7217315          ?        ? 
1 1 1   24    1    2 o 24.63194 1.587117   48.01848    45.3   6.074574 0.7818757          ?        ? 
1 1 1   24    1    3 o 197.9789 1.389846   287.3763     4.5   392.3212 5.503202          ?        ? 
1 1 1   24    1    4 o 28.11100 1.337205   48.60428   193.6   7.908974 0.7518036          ?        ? 
1 1 1   24    1    5 o 35.48441 1.101717   56.41045   184.2   12.60023 0.7818757          ?        ? 
1 1 1   24    1    6 o 88.62412 0.8992043   114.9928    19.8   78.57851 1.593824          ?        ? 
1 1 1   24    1    7 o 44.03154 0.8878587   50.39272   250.7   19.39653 0.7818757          ?        ? 
1 1 1   24    1    8 o 71.06146 0.8463700   87.62291   281.7   50.52120 1.202886          ?        ? 
1 1 1   24    1    9 o 40.40102 0.7443411   72.08859   300.3   16.32917 0.6014429          ?        ? 
1 1 1   24    1   10 o 62.65965 1.391793   82.61848   178.7   39.33437 1.744184          ?        ? 
1 1 1   24    1   11 o 8.928596 3.304273   2.602915   173.0  0.6315150 0.7818757          ?        ? 
1 1 1   24    1   12 x        ?      ?   104.2378    36.5          ?        ?          ?        ? 
1 1 1   24    1   13 o 8.373747 3.938997   10.59808    74.5  -1.774257 1.714112          ?        ? 
1 1 1   24    1   14 o 23.18862 4.311090   37.27708   293.3   5.803924 1.924617          ?        ? 
1 1 1   24    1   15 o 7.886998 3.813036   7.803910    20.1  -2.706493 1.834401          ?        ? 
1 1 1   24    1   16 o 16.95631 6.387062   14.04795    18.6   3.157575 2.947070          ?        ? 
1 1 1   24    1   17 o 12.05555 5.088202   9.012818   349.3  0.7818757 2.105050          ?        ? 
1 1 1   24    1   18 o 21.09785 3.993693   19.21303   354.4   5.142337 1.623896          ?        ? 
1 1 1   24    1   19 o 9.261384 4.330658   9.685956   182.0 -0.8119479 1.984761          ?        ? 
1 1 1   24    2    0 f 66.23530 1.272303   91.85898     0.0   43.93541 1.684040   43.93541 1.684040 
1 1 1   24    2    1 o 120.6878 1.058985   148.6779   358.4   145.7296 2.556132          ?        ? 
1 1 1   24    2    2 o 89.03359 0.8950688   141.8839   270.2   79.30025 1.593824          ?        ? 
1 1 1   24    2    3 o 102.1149 0.9571033   142.7397   120.8   104.3203 1.954689          ?        ? 
1 1 1   24    2    4 o 74.25053 0.8910202   123.6723    99.9   55.15231 1.323174          ?        ? 
1 1 1   24    2    5 o 78.51753 0.8808979   120.9384   101.3   61.67797 1.383319          ?        ? 
1 1 1   24    2    6 o 86.51382 0.8863783   129.0757   153.5   74.87964 1.533679          ?        ? 
1 1 1   24    2    7 o 67.68385 0.8441759   72.93447   189.8   45.82995 1.142741          ?        ? 
1 1 1   24    2    8 o 53.23792 0.9037814   68.64240   296.5   28.35803 0.9623086          ?        ? 
1 1 1   24    2    9 o 54.62086 1.101123   52.31683    49.9   29.86164 1.202886          ?        ? 
1 1 1   24    2   10 o 54.47484 1.131677   72.28262    71.5   29.71128 1.232958          ?        ? 
1 1 1   24    2   11 o 77.80505 1.275471   95.50454     5.5   60.65551 1.984761          ?        ? 
1 1 1   24    2   12 o 46.12079 1.238857   68.74745    29.7   21.32115 1.142741          ?        ? 
1 1 1   24    2   13 o 31.93887 3.436670   46.80600    72.4   10.46511 2.195267          ?        ? 
1 1 1   24    2   14 o 9.360806 4.211436   32.40091   193.6 -0.6615872 1.653968          ?        ? 
1 1 1   24    2   15 o 10.41001 4.537798   13.47578   255.1      -0.09 1.774257          ?        ? 
1 1 1   24    2   16 o 41.04916 1.648324   58.69895   260.1   17.08098 1.353247          ?        ? 
1 1 1   24    2   17 o 13.10563 5.306213   13.29428    44.2   1.413391 2.165194          ?        ? 
1 1 1   24    2   18 o 13.06951 5.278438   18.40645   253.6   1.653968 2.135122          ?        ? 
1 1 1   24    2   19 o 8.809245 4.239170   8.340346   213.2  -1.924617 2.195267          ?        ? 
1 1 1   24    3    0 o 10.65501 4.576346   2.116171   180.0   1.623896 0.9923807   1.623896 0.9923807 
1 1 1   24    3    1 o 114.4115 1.025084   170.1444   217.7   130.9642 2.345627          ?        ? 
1 1 1   24    3    2 o 17.99780 2.339231   33.46191    59.3   3.247792 0.8420200          ?        ? 
1 1 1   24    3    3 o 124.8708 1.083717   195.5643   158.4   156.0143 2.706493          ?        ? 
1 1 1   24    3    4 o 21.98799 1.709578   41.43490   154.2   4.841615 0.7518036          ?        ? 
1 1 1   24    3    5 o 52.72769 0.9410432   91.80858    72.4   27.81673 0.9923807          ?        ? 
1 1 1   24    3    6 o 42.11015 0.9997827   58.07510   328.6   17.74257 0.8420200          ?        ? 
1 1 1   24    3    7 o 64.09852 0.9617679   79.81767   223.9   41.10862 1.232958          ?        ? 
1 1 1   24    3    8 o 52.67002 0.9135259   94.29222   343.4   27.75659 0.9623086          ?        ? 
1 1 1   24    3    9 o 48.03165 1.189571   86.21149   333.9   23.09541 1.142741          ?        ? 
1 1 1   24    3   10 o 50.40808 1.133490   82.88830   324.5   25.44103 1.142741          ?        ? 
1 1 1   24    3   11 o 21.02937 2.288011   30.21879   320.4   4.450677 0.9623086          ?        ? 
1 1 1   24    3   12 o 65.66827 1.167748   86.39234   265.4   43.21367 1.533679          ?        ? 
1 1 1   24    3   13 o 25.02797 1.922466   35.97382    26.1   6.315150 0.9623086          ?        ? 
1 1 1   24    3   14 o 28.27205 1.276405   37.34845   150.8   8.029263 0.7217315          ?        ? 
1 1 1   24    3   15 o 57.12384 1.000232   71.24073   182.8   32.74857 1.142741          ?        ? 
1 1 1   24    3   16 o 29.95157 1.054227   31.66974   146.4   9.021644 0.6315150          ?        ? 
1 1 1   24    3   17 o 15.43089 5.486843   5.475582   131.9   2.736565 2.135122          ?        ? 
1 1 1   24    3   18 o 18.13025 4.692180   19.60549   268.7   4.029667 1.714112          ?        ? 
1 1 1   24    3   19 o 10.72044 3.236314   7.721336   187.3   1.323174 0.7518036          ?        ? 
1 1 1   24    4    0 o 67.98226 1.261675   108.8036   180.0   46.28103 1.714112   46.28103 1.714112 
1 1 1   24    4    1 o 34.10279 1.190442   54.57508     5.8   11.63792 0.8119479          ?        ? 
1 1 1   24    4    2 o 78.04037 0.8862839   74.80840    61.6   60.92617 1.383319          ?        ? 
1 1 1   24    4    3 o 154.0630 1.180923   227.1152    22.7   237.5098 3.638730          ?        ? 
1 1 1   24    4    4 o 52.90052 0.9379687   119.0289    80.0   27.99717 0.9923807          ?        ? 
1 1 1   24    4    5 o 73.38890 0.9629459   93.95092     9.9   53.88928 1.413391          ?        ? 
1 1 1   24    4    6 o 39.41480 1.182597   47.98845   165.9   15.54730 0.9322364          ?        ? 
1 1 1   24    4    7 o 80.34881 0.9543884   101.3795   107.2   64.59497 1.533679          ?        ? 
1 1 1   24    4    8 o 23.70000 1.332310   42.03216   270.3   5.623491 0.6315150          ?        ? 
1 1 1   24    4    9 o 71.38235 1.095335   93.98287   104.8   51.00236 1.563751          ?        ? 
1 1 1   24    4   10 f 38.31462 1.334285   63.03672    72.9   14.70528 1.022453          ?        ? 
1 1 1   24    4   11 o 46.56554 1.485346   47.89860   262.3   21.74216 1.383319          ?        ? 
1 1 1   24    4   12 o 26.41121 2.391087   27.85324   127.0   7.036882 1.263030          ?        ? 
1 1 1   24    4   13 o 33.36538 1.847661   44.50692    38.3   11.21691 1.232958          ?        ? 
1 1 1   24    4   14 o 39.87411 1.696899   46.89865    85.4   16.02845 1.353247          ?        ? 
1 1 1   24    4   15 o 9.548691 3.384747   10.40976    19.0  0.8420200 0.8119479          ?        ? 
1 1 1   24    4   16 o 18.16770 2.400117   36.22583   284.8   3.398152 0.8720922          ?        ? 
1 1 1   24    4   17 o 14.47888 3.007951   23.39878   241.2   2.285483 0.8420200          ?        ? 
1 1 1   24    4   18 o 7.586414 3.241189   13.23316   276.5  0.1202886 0.8720922          ?        ? 
1 1 1   24    4   19 o 25.64201 1.993707   31.66809     7.8   6.886521 1.022453          ?        ? 
1 1 1   24    5    0 o 88.48193 1.258080   136.4312   180.0   78.36801 2.225339   78.36801 2.225339 
1 1 1   24    5    1 o 82.80324 0.9624164   121.3908   111.1   68.59457 1.593824          ?        ? 
1 1 1   24    5    2 o 82.92984 0.9790781   124.1980   169.1   68.80507 1.623896          ?        ? 
1 1 1   24    5    3 o 103.3295 0.9604040   138.2347   115.7   106.8163 1.984761          ?        ? 
1 1 1   24    5    4 o 16.05599 2.434841   11.79571    19.2   2.586205 0.7818757          ?        ? 
1 1 1   24    5    5 o 55.20301 1.035036   77.22512   104.4   30.49315 1.142741          ?        ? 
1 1 1   24    5    6 o 137.5002 1.202884   185.4193    93.0   189.2139 3.307936          ?        ? 
1 1 1   24    5    7 o 80.55270 0.9706389   102.6774    61.7   64.92576 1.563751          ?        ? 
1 1 1   24    5    8 o 37.49313 1.323417   58.42255    87.9   14.07376 0.9923807          ?        ? 
1 1 1   24    5    9 o 84.23647 1.124540   94.76518   321.3   71.03040 1.894545          ?        ? 
1 1 1   24    5   10 o 36.62918 1.395681   62.11246   115.5   13.44225 1.022453          ?        ? 
1 1 1   24    5   11 o 12.47083 3.484163   6.409354    56.6   1.623896 0.9021643          ?        ? 
1 1 1   24    5   12 o 14.68347 3.845675   34.51739    23.4   2.285483 1.142741          ?        ? 
1 1 1   24    5   13 o 11.06674 4.212750   23.83027   203.0  0.9322364 1.293102          ?        ? 
1 1 1   24    5   14 o 25.52500 2.650826   32.35306   145.3   6.645944 1.353247          ?        ? 
1 1 1   24    5   15 o 38.24589 1.769140   48.84193   178.7   14.79550 1.353247          ?        ? 
1 1 1   24    5   16 o 6.476513 3.004922   13.48091   283.4 -0.7217315 0.9322364          ?        ? 
1 1 1   24    5   17 o 38.88908 1.507896   50.79179   333.2   15.33679 1.172814          ?        ? 
1 1 1   24    5   18 o 9.631316 3.768264   14.25208   165.5  0.7818757 1.052525          ?        ? 
1 1 1   24    5   19 o 13.61184 3.821188   14.71712    44.0   2.255411 1.082597          ?        ? 
1 1 1   24    6    0 o 67.37629 1.340176   85.82627     0.0   45.46908 1.804329   45.46908 1.804329 
1 1 1   24    6    1 o 69.97404 1.009939   107.1201    72.6   48.98752 1.413391          ?        ? 
1 1 1   24    6    2 f 121.2622 1.190366   137.3483    27.6   147.1430 2.886926          ?        ? 
1 1 1   24    6    3 f 85.09204 1.024881   135.9126   119.5   72.44379 1.744184          ?        ? 
1 1 1   24    6    4 o 36.27537 1.284944   49.43921   289.7   13.17160 0.9322364          ?        ? 
1 1 1   24    6    5 o 32.56447 1.339024   37.92786   335.1   10.61547 0.8720922          ?        ? 
1 1 1   24    6    6 o 88.39984 0.9865314   125.9840   322.0   78.18758 1.744184          ?        ? 
1 1 1   24    6    7 o 62.98360 1.002666   75.98984   260.4   39.69523 1.263030          ?        ? 
1 1 1   24    6    8 o 44.86079 1.307170   82.48081   258.2   20.14834 1.172814          ?        ? 
1 1 1   24    6    9 o 79.46937 1.286600   105.5370   267.8   63.24172 2.044906          ?        ? 
1 1 1   24    6   10 o 26.25635 1.832526   46.52168    33.6   6.916593 0.9623086          ?        ? 
1 1 1   24    6   11 o 69.82056 1.227512   110.9823   108.4   48.83716 1.714112          ?        ? 
1 1 1   24    6   12 o 48.89520 1.568333   65.59664   167.5   23.99757 1.533679          ?        ? 
1 1 1   24    6   13 o 35.08923 1.971144   50.54753   114.0   12.41980 1.383319          ?        ? 
1 1 1   24    6   14 o 22.34232 3.230335   33.66225    67.1   5.142337 1.443463          ?        ? 
1 1 1   24    6   15 o 37.71761 1.993243   53.33455    81.9   14.43463 1.503607          ?        ? 
1 1 1   24    6   16 o 18.04671 3.786836   25.77515   203.6   3.608657 1.323174          ?        ? 
1 1 1   24    6   17 o 12.91611 3.880452   17.83527   297.4   1.864473 1.082597          ?        ? 
1 1 1   24    6   18 o 9.413468 3.776462   13.98539    73.3  0.6615872 1.082597          ?        ? 
1 1 1   24    6   19 o 11.32817 3.967551   12.57047   247.3   1.503607 1.112669          ?        ? 
1 1 1   24    7    0 o 102.6832 1.626304   124.1553    -0.0   105.5833 3.338008   105.5833 3.338008 
1 1 1   24    7    1 o 62.17093 1.064142   90.49622   337.9   38.67278 1.323174          ?        ? 
1 1 1   24    7    2 o 144.0964 1.387819   181.6214   263.2   207.8286 3.999595          ?        ? 
1 1 1   24    7    3 o 54.98573 1.066471   55.00934   281.2   30.25258 1.172814          ?        ? 
1 1 1   24    7    4 o 30.11575 1.497828   58.42688    89.1   9.081788 0.9021643          ?        ? 
1 1 1   24    7    5 o 60.52820 1.018499   78.73365   161.9   36.65794 1.232958          ?        ? 
1 1 1   24    7    6 o 119.2412 1.197930   150.6957   232.6   142.3014 2.856854          ?        ? 
1 1 1   24    7    7 f 40.13021 1.161514   58.73317   249.7   16.11867 0.9322364          ?        ? 
1 1 1   24    7    8 o 36.38670 1.528950   49.34262   249.0   13.26182 1.112669          ?        ? 
1 1 1   24    7    9 o 35.62106 1.688448   46.64657   104.7   12.72052 1.202886          ?        ? 
1 1 1   24    7   10 o 20.00784 2.555130   18.77336   291.8   4.029667 1.022453          ?        ? 
1 1 1   24    7   11 o 80.93750 1.318995   104.6575   156.7   65.64749 2.135122          ?        ? 
1 1 1   24    7   12 o 56.57121 1.488425   86.21991    46.9   32.11705 1.684040          ?        ? 
1 1 1   24    7   13 o 28.41715 2.381039   36.10969   119.4   8.179624 1.353247          ?        ? 
1 1 1   24    7   14 o 31.28750 2.162599   38.84546    22.6   9.923808 1.353247          ?        ? 
1 1 1   24    7   15 o 7.691391 3.627960   6.043371   267.9  -1.533679 1.473535          ?        ? 
1 1 1   24    7   16 o 29.73195 2.680321   42.85812   191.8   9.172004 1.593824          ?        ? 
1 1 1   24    7   17 o 18.19600 2.892188   26.53657   331.0   3.488369 1.052525          ?        ? 
1 1 1   24    7   18 o 12.40597 4.030096   12.35520     9.6   1.774257 1.142741          ?        ? 
1 1 1   24    7   19 o 14.54913 4.075856   30.22435   243.6   2.646349 1.232958          ?        ? 
1 1 1   24    8    0 o 9.323301 4.996884   2.960692   180.0   1.263030 1.263030   1.263030 1.263030 
1 1 1   24    8    1 o 41.92884 1.183411   73.65854    51.2   17.59221 0.9923807          ?        ? 
1 1 1   24    8    2 o 63.17604 1.071012   71.05624   246.4   39.93581 1.353247          ?        ? 
1 1 1   24    8    3 f 63.15168 1.023807   86.91812   281.5   39.90574 1.293102          ?        ? 
1 1 1   24    8    4 o 82.39613 1.021917   98.27090    60.9   67.93298 1.684040          ?        ? 
1 1 1   24    8    5 o 26.73190 1.687430   46.85130    62.3   7.157170 0.9021643          ?        ? 
1 1 1   24    8    6 o 48.72092 1.172742   63.98526   201.1   23.75699 1.142741          ?        ? 
1 1 1   24    8    7 f 53.71500 0.9237464   100.4723   293.0   28.86926 0.9923807          ?        ? 
1 1 1   24    8    8 o 90.62018 1.261023   134.5882   143.4   82.21724 2.285483          ?        ? 
1 1 1   24    8    9 o 32.84923 1.876692   64.11004    91.2   10.82597 1.232958          ?        ? 
1 1 1   24    8   10 o 53.98621 1.309029   98.39498   157.9   29.20005 1.413391          ?        ? 
1 1 1   24    8   11 o 24.69038 2.192347   23.20324     1.0   6.134717 1.082597          ?        ? 
1 1 1   24    8   12 o 41.55449 1.917752   44.37051   295.2   17.38170 1.593824          ?        ? 
1 1 1   24    8   13 o 17.78755 3.909959   34.04464   141.4   3.398152 1.353247          ?        ? 
1 1 1   24    8   14 o 14.16385 4.413299   18.08011   194.5   2.135122 1.383319          ?        ? 
1 1 1   24    8   15 o 27.13295 2.549150   30.98390   347.1   7.548109 1.383319          ?        ? 
1 1 1   24    8   16 o 30.43562 2.321935   46.37576   233.9   9.532870 1.413391          ?        ? 
1 1 1   24    8   17 o 11.94088 4.543538   11.86114     1.8   1.353247 1.503607          ?        ? 
1 1 1   24    8   18 o 23.20901 2.461849   32.58443   214.3   5.683635 1.142741          ?        ? 
1 1 1   24    8   19 o 15.22871 3.997426   25.20157   208.8   2.886926 1.232958          ?        ? 
1 1 1   24    9    0 o 4.055992 2.936838   6.006271     0.0  -1.894545 1.142741  -1.894545 1.142741 
1 1 1   24    9    1 o 130.4094 1.372058   169.2949   158.3   170.2384 3.578585          ?        ? 
1 1 1   24    9    2 o 178.9882 1.646517   225.6928   106.6   320.8698 5.894140          ?        ? 
1 1 1   24    9    3 o 106.5671 1.255745   149.0254    77.0   113.6727 2.676421          ?        ? 
1 1 1   24    9    4 o 20.04915 2.099890   17.60508    87.6   4.029667 0.8420200          ?        ? 
1 1 1   24    9    5 o 50.24081 1.167192   76.50486   215.9   25.26060 1.172814          ?        ? 
1 1 1   24    9    6 o 37.96951 1.386014   58.62240   189.0   14.43463 1.052525          ?        ? 
1 1 1   24    9    7 o 43.61435 1.034252   55.70113   171.1   19.03567 0.9021643          ?        ? 
1 1 1   24    9    8 o 50.55542 1.278896   57.85130    22.6   25.59139 1.293102          ?        ? 
1 1 1   24    9    9 o 28.06719 2.035725   28.05398   164.7   7.908974 1.142741          ?        ? 
1 1 1   24    9   10 o 24.43989 2.399384   37.32060     9.2   6.014429 1.172814          ?        ? 
1 1 1   24    9   11 f 50.04284 1.352088   57.66273   186.8   25.11024 1.353247          ?        ? 
1 1 1   24    9   12 o 20.46120 2.498516   27.09655   109.8   4.240172 1.022453          ?        ? 
1 1 1   24    9   13 o 23.27859 2.906633   46.72488    57.9   5.533275 1.353247          ?        ? 
1 1 1   24    9   14 o 47.24522 1.686757   67.01221   241.7   22.52404 1.593824          ?        ? 
1 1 1   24    9   15 o 13.29398 4.434069   15.18384   246.9   1.864473 1.383319          ?        ? 
1 1 1   24    9   16 o 17.01709 4.032671   19.88443    34.4   3.277864 1.353247          ?        ? 
1 1 1   24    9   17 o 9.842243 4.086961   9.723375   104.4  0.5112265 1.323174          ?        ? 
1 1 1   24    9   18 o 9.667747 4.236738   8.700298    33.2  0.1804329 1.563751          ?        ? 
1 1 1   24    9   19 o 13.38101 3.912564   11.37312    45.0   2.225339 1.112669          ?        ? 
1 1 1   24   10    0 o 133.8023 2.057556   193.5565   180.0   179.3803 5.503202   179.3803 5.503202 
1 1 1   24   10    1 o 61.21189 1.179071   73.41344    99.9   37.49996 1.443463          ?        ? 
1 1 1   24   10    2 o 72.68342 1.096415   89.83114   275.8   52.86683 1.593824          ?        ? 
1 1 1   24   10    3 o 68.18298 1.102627   87.29562   290.7   46.52161 1.503607          ?        ? 
1 1 1   24   10    4 o 74.23920 1.113945   95.67790   234.0   55.15231 1.653968          ?        ? 
1 1 1   24   10    5 f 41.45578 1.233185   43.98735   249.8   17.20127 1.022453          ?        ? 
1 1 1   24   10    6 o 29.71849 1.264875   43.26470    45.9   8.841210 0.7518036          ?        ? 
1 1 1   24   10    7 o 38.56715 1.052642   44.38895   260.2   14.88571 0.8119479          ?        ? 
1 1 1   24   10    8 o 72.88497 1.299682   97.40738   217.5   53.19762 1.894545          ?        ? 
1 1 1   24   10    9 o 17.27589 3.516458   34.77520   312.8   3.127503 1.172814          ?        ? 
1 1 1   24   10   10 o 53.02264 1.361176   58.95041    14.0   28.17760 1.443463          ?        ? 
1 1 1   24   10   11 o 24.72755 2.310665   14.65217    76.3   6.164790 1.142741          ?        ? 
1 1 1   24   10   12 o 35.69162 1.600854   41.74347   124.3   12.81073 1.142741          ?        ? 
1 1 1   24   10   13 o 22.71198 3.111554   30.79875   181.5   5.292697 1.413391          ?        ? 
1 1 1   24   10   14 o 28.87960 2.447040   36.39875   131.8   8.510417 1.413391          ?        ? 
1 1 1   24   10   15 o 16.33257 4.342793   17.39903   297.4   3.007215 1.443463          ?        ? 
1 1 1   24   10   16 o 14.91049 4.363427   21.85042    26.7   2.556132 1.383319          ?        ? 
1 1 1   24   10   17 o 14.79711 4.543766   9.676329   262.8   2.586205 1.473535          ?        ? 
1 1 1   24   10   18 o 14.27593 4.463578   13.49281   110.4   2.526060 1.413391          ?        ? 
1 1 1   24   11    0 o 80.44148 1.608942   130.0536    -0.0   64.83555 2.586205   64.83555 2.586205 
1 1 1   24   11    1 o 49.75967 1.148261   92.91389   263.8   24.77945 1.142741          ?        ? 
1 1 1   24   11    2 o 111.1464 1.312232   133.3371   274.7   123.6567 2.916998          ?        ? 
1 1 1   24   11    3 o 43.43860 1.246124   49.78112   219.6   18.88531 1.082597          ?        ? 
1 1 1   24   11    4 o 94.55163 1.129078   129.9090   321.8   89.46463 2.135122          ?        ? 
1 1 1   24   11    5 o 15.29579 3.057161   19.55550   120.5   2.435844 0.9021643          ?        ? 
1 1 1   24   11    6 o 46.71074 0.9656926   22.30985     8.8   21.83238 0.9021643          ?        ? 
1 1 1   24   11    7 o 97.36863 1.003757   117.5689    80.1   94.87762 1.954689          ?        ? 
1 1 1   24   11    8 o 31.25546 1.972388   57.24397   204.8   9.803518 1.232958          ?        ? 
1 1 1   24   11    9 o 44.15440 1.600509   59.16672   302.1   19.54689 1.413391          ?        ? 
1 1 1   24   11   10 o 71.19988 1.267087   91.78441    98.5   50.79185 1.804329          ?        ? 
1 1 1   24   11   11 o 10.45138 3.838701   11.28637    33.0  0.9021643 1.052525          ?        ? 
1 1 1   24   11   12 o 38.51111 1.600782   63.51447   273.6   14.91578 1.232958          ?        ? 
1 1 1   24   11   13 o 13.62778 4.271112   20.75946   294.6   1.954689 1.293102          ?        ? 
1 1 1   24   11   14 f 10.51055 4.305252   13.87082   120.5  0.5412986 1.443463          ?        ? 
1 1 1   24   11   15 o 50.04078 1.712715   61.95720   231.6   25.41096 1.714112          ?        ? 
1 1 1   24   11   16 o 21.63710 3.405112   34.28462   245.4   5.022048 1.473535          ?        ? 
1 1 1   24   11   17 o 24.76515 3.521450   37.66666   243.2   6.736160 1.744184          ?        ? 
1 1 1   24   11   18 o 10.50287 4.358716   14.24546   297.5  0.8720922 1.503607          ?        ? 
1 1 1   24   12    0 o 179.2964 2.181124   182.1468     0.0   322.0426 7.818758   322.0426 7.818758 
1 1 1   24   12    1 o 22.91231 2.099982   16.73793   140.2   5.262625 0.9623086          ?        ? 
1 1 1   24   12    2 o 69.72926 1.142866   103.8835   270.0   48.65673 1.593824          ?        ? 
1 1 1   24   12    3 o 84.40720 1.175706   113.5421   292.0   71.30106 1.984761          ?        ? 
1 1 1   24   12    4 o 8.431011 3.386506   28.17371   215.3  0.3307936 0.8720922          ?        ? 
1 1 1   24   12    5 o 97.76720 1.091942   122.8277    88.0   95.65949 2.135122          ?        ? 
1 1 1   24   12    6 f 51.57124 0.9913016   69.74611   283.4   26.61385 1.022453          ?        ? 
1 1 1   24   12    7 o 42.60080 1.023563   65.93066   117.1   18.16358 0.8720922          ?        ? 
1 1 1   24   12    8 o 40.04877 1.126332   55.94010   227.6   16.05853 0.9021643          ?        ? 
1 1 1   24   12    9 o 34.05909 1.677587   63.91314   283.2   11.63792 1.142741          ?        ? 
1 1 1   24   12   10 o 38.82132 1.665454   66.25683   175.1   15.12629 1.293102          ?        ? 
1 1 1   24   12   11 o 92.55810 1.299601   130.7101   253.8   85.91612 2.405771          ?        ? 
1 1 1   24   12   12 o 63.80153 1.319749   91.48378   262.7   40.86804 1.684040          ?        ? 
1 1 1   24   12   13 o 16.46311 4.042738   18.96335    88.4   2.947070 1.323174          ?        ? 
1 1 1   24   12   14 o 39.31826 1.912098   55.80227   183.3   15.66759 1.503607          ?        ? 
1 1 1   24   12   15 o 9.540880 4.102814   17.55025   179.2  0.1202886 1.413391          ?        ? 
1 1 1   24   12   16 o 26.79350 2.637562   32.29951   220.6   7.487964 1.413391          ?        ? 
1 1 1   24   12   17 o 13.40566 4.529444   14.09705   354.7   2.105050 1.443463          ?        ? 
1 1 1   24   12   18 o 14.59453 4.500339   24.54278   297.6   2.736565 1.443463          ?        ? 
1 1 1   24   13    0 o 33.73572 2.248872   40.24055    -0.0   11.54770 1.503607   11.54770 1.503607 
1 1 1   24   13    1 o 42.63594 1.234317   52.23985   226.2   18.19365 1.052525          ?        ? 
1 1 1   24   13    2 o 133.8445 1.314376   157.7200   165.2   179.3202 3.518441          ?        ? 
1 1 1   24   13    3 o 65.08897 1.178141   100.4308   307.5   42.40173 1.533679          ?        ? 
1 1 1   24   13    4 o 11.13489 3.640029   8.443260   177.7   1.202886 0.9322364          ?        ? 
1 1 1   24   13    5 o 56.09056 1.072271   60.04840   350.7   31.48553 1.202886          ?        ? 
1 1 1   24   13    6 o 55.47040 1.030046   56.93473   115.2   30.79388 1.142741          ?        ? 
1 1 1   24   13    7 o 9.474446 3.202801   12.59564    89.9  0.8420200 0.7217315          ?        ? 
1 1 1   24   13    8 o 25.28776 1.308117   46.25545   347.9   6.405366 0.6615872          ?        ? 
1 1 1   24   13    9 o 86.89880 1.263117   111.8335   345.1   75.66151 2.195267          ?        ? 
1 1 1   24   13   10 o 16.32337 3.759623   33.33730   221.2   2.826782 1.202886          ?        ? 
1 1 1   24   13   11 o 17.73249 3.601903   38.15814   239.6   3.338008 1.232958          ?        ? 
1 1 1   24   13   12 o 26.46572 2.329349   37.44292    27.3   7.097026 1.232958          ?        ? 
1 1 1   24   13   13 o 24.05968 2.437301   39.31672   160.3   5.894140 1.172814          ?        ? 
1 1 1   24   13   14 o 14.37366 4.618427   24.86773   232.6   2.225339 1.503607          ?        ? 
1 1 1   24   13   15 o 20.45216 3.889714   21.08321   187.1   4.631110 1.533679          ?        ? 
1 1 1   24   13   16 o 7.746842 3.470799   6.251559   146.4 -0.3307936 1.112669          ?        ? 
1 1 1   24   13   17 o 15.18205 4.461880   27.21532   289.1   2.796710 1.443463          ?        ? 
1 1 1   24   13   18 o 10.14463 4.244087   24.89439   164.7  0.7818757 1.443463          ?        ? 
1 1 1   24   14    0 o 54.54158 1.712938   47.61747   180.0   29.86164 1.864473   29.86164 1.864473 
1 1 1   24   14    1 o 54.06935 1.195781   47.53435   121.4   29.26020 1.293102          ?        ? 
1 1 1   24   14    2 o 81.15286 1.204326   121.1893   194.7   65.91814 1.954689          ?        ? 
1 1 1   24   14    3 o 133.3411 1.398274   155.5507   201.5   178.0271 3.728946          ?        ? 
1 1 1   24   14    4 o 29.04921 1.449300   29.90868   332.3   8.450273 0.8420200          ?        ? 
1 1 1   24   14    5 o 17.81884 2.362725   31.30139   208.8   3.187647 0.8420200          ?        ? 
1 1 1   24   14    6 o 18.72177 2.168459   30.30768   175.2   3.518441 0.8119479          ?        ? 
1 1 1   24   14    7 o 6.678027 2.902446   32.49214   219.6 -0.1202886 0.7217315          ?        ? 
1 1 1   24   14    8 o 43.05280 0.9778924   49.92255   223.6   18.55451 0.8420200          ?        ? 
1 1 1   24   14    9 o 74.88582 1.365349   100.2818    37.7   56.20484 2.044906          ?        ? 
1 1 1   24   14   10 o 14.24250 4.037484   21.01165    35.8   2.135122 1.202886          ?        ? 
1 1 1   24   14   11 o 50.14473 1.439297   70.10458   126.6   25.26060 1.443463          ?        ? 
1 1 1   24   14   12 f 18.13424 3.359904   31.02456    15.9   3.488369 1.172814          ?        ? 
1 1 1   24   14   13 o 7.789004 3.539555   4.021555    28.1 -0.6315150 1.202886          ?        ? 
1 1 1   24   14   14 o 37.46412 2.127133   54.66990   219.8   14.31434 1.593824          ?        ? 
1 1 1   24   14   15 o 12.89542 4.560904   11.69297    99.5   1.744184 1.473535          ?        ? 
1 1 1   24   14   16 f 10.52093 4.046411   15.39115   233.9  0.9623086 1.202886          ?        ? 
1 1 1   24   14   17 o 9.343047 4.103446   7.199590   218.5       0.09 1.473535          ?        ? 
1 1 1   24   14   18 o 19.81072 4.155475   28.74955    87.5   4.871688 1.593824          ?        ? 
1 1 1   24   15    0 o 58.78971 1.639685   87.36407     0.0   34.67318 1.924617   34.67318 1.924617 
1 1 1   24   15    1 o 79.46982 1.173070   78.81986    44.5   63.21165 1.864473          ?        ? 
1 1 1   24   15    2 o 61.89312 1.166093   73.01829    25.5   38.34198 1.443463          ?        ? 
1 1 1   24   15    3 o 56.64398 1.221064   79.93288   285.5   32.11705 1.383319          ?        ? 
1 1 1   24   15    4 o 20.04101 2.175770   33.86494    16.0   4.029667 0.8720922          ?        ? 
1 1 1   24   15    5 o 60.47282 0.9945672   69.42856   177.8   36.59780 1.202886          ?        ? 
1 1 1   24   15    6 o 13.90056 2.802523   10.78794   104.5   2.014834 0.7518036          ?        ? 
1 1 1   24   15    7 o 52.97062 1.021885   74.05576   325.2   28.08738 1.082597          ?        ? 
1 1 1   24   15    8 o 50.70660 0.9785520   59.67065    20.9   25.74175 0.9923807          ?        ? 
1 1 1   24   15    9 o 38.29472 1.845412   40.16602   246.4   14.73535 1.413391          ?        ? 
1 1 1   24   15   10 o 10.19449 4.111723   17.06953   278.5  0.5112265 1.293102          ?        ? 
1 1 1   24   15   11 o 8.516006 3.746797   19.64288   354.3 -0.2706493 1.232958          ?        ? 
1 1 1   24   15   12 o 27.75677 2.275175   42.33981   271.8   7.818758 1.263030          ?        ? 
1 1 1   24   15   13 o 53.55941 1.431755   69.74441   149.5   28.89933 1.533679          ?        ? 
1 1 1   24   15   14 o 18.18397 4.071187   29.99805   234.9   3.698874 1.443463          ?        ? 
1 1 1   24   15   15 o 18.79962 4.112101   30.93794    51.3   4.029667 1.503607          ?        ? 
1 1 1   24   15   16 o 16.68615 4.155869   16.63546   279.9   3.247792 1.383319          ?        ? 
1 1 1   24   15   17 o 7.664914 3.653008   5.818831    16.1  -1.413391 1.533679          ?        ? 
1 1 1   24   15   18 o 7.570603 3.595142   14.63292   170.9  -1.142741 1.473535          ?        ? 
1 1 1   24   16    0 o 73.79030 1.652360   112.0190    -0.0   54.58094 2.435844   54.58094 2.435844 
1 1 1   24   16    1 o 51.35599 1.288238   68.52452    33.2   26.40334 1.323174          ?        ? 
1 1 1   24   16    2 o 23.67233 2.286630   32.47382    92.8   5.623491 1.082597          ?        ? 
1 1 1   24   16    3 o 25.74993 1.810173   8.777155    45.4   6.645944 0.9322364          ?        ? 
1 1 1   24   16    4 o 17.81566 2.363146   1.891590   283.2   3.187647 0.8420200          ?        ? 
1 1 1   24   16    5 o 12.28625 3.500937   25.08932   280.6   1.563751 0.9021643          ?        ? 
1 1 1   24   16    6 o 31.03586 1.501870   47.95615   222.6   9.653158 0.9322364          ?        ? 
1 1 1   24   16    7 o 36.01224 1.252580   40.34616   342.4   12.99117 0.9021643          ?        ? 
1 1 1   24   16    8 o 70.71971 0.9780291   83.73787   131.0   50.07012 1.383319          ?        ? 
1 1 1   24   16    9 o 27.76119 1.354055   42.14552   123.3   7.728541 0.7518036          ?        ? 
1 1 1   24   16   10 o 61.96369 1.383159   81.04365   309.9   38.55249 1.714112          ?        ? 
1 1 1   24   16   11 o 27.82439 2.377724   41.39867   299.1   7.848830 1.323174          ?        ? 
1 1 1   24   16   12 o 55.83372 1.427295   72.37637    55.0   31.36525 1.593824          ?        ? 
1 1 1   24   16   13 o 31.49453 2.052900   41.03537    23.3   10.07417 1.293102          ?        ? 
1 1 1   24   16   14 o 9.025105 3.903196   14.28013   263.7       0.03 1.293102          ?        ? 
1 1 1   24   16   15 o 22.89861 3.283184   24.36012   270.5   5.593419 1.503607          ?        ? 
1 1 1   24   16   16 o 16.04597 4.443001   26.17462   161.1   3.097431 1.473535          ?        ? 
1 1 1   24   16   17 o 6.348553 3.139394   4.539521    36.4  -2.796710 1.473535          ?        ? 
1 1 1   24   17    0 o 73.74499 1.673838   96.11745    -0.0   54.52080 2.465916   54.52080 2.465916 
1 1 1   24   17    1 o 47.11424 1.276563   55.98896   157.6   22.22332 1.202886          ?        ? 
1 1 1   24   17    2 o 61.18618 1.081269   93.08096    32.7   37.46989 1.323174          ?        ? 
1 1 1   24   17    3 o 55.73565 1.106077   64.37222   136.4   31.09460 1.232958          ?        ? 
1 1 1   24   17    4 o 54.78347 1.070408   64.04463   153.6   30.04207 1.172814          ?        ? 
1 1 1   24   17    5 o 37.80319 1.312562   33.83439   258.7   14.31434 0.9923807          ?        ? 
1 1 1   24   17    6 o 71.96497 1.023787   103.1469   272.0   51.84438 1.473535          ?        ? 
1 1 1   24   17    7 o 31.89474 1.319998   18.51833    30.8   10.19446 0.8420200          ?        ? 
1 1 1   24   17    8 o 36.46250 1.195876   51.91663   241.1   13.32196 0.8720922          ?        ? 
1 1 1   24   17    9 o 53.12966 0.9339236   75.67305   194.4   28.26782 0.9923807          ?        ? 
1 1 1   24   17   10 f 18.16093 3.436758   34.66149   175.1   3.488369 1.202886          ?        ? 
1 1 1   24   17   11 o 34.99187 1.847718   52.56985   261.5   12.35965 1.293102          ?        ? 
1 1 1   24   17   12 o 13.04693 4.236900   19.05054   354.1   1.774257 1.263030          ?        ? 
1 1 1   24   17   13 o 36.89457 1.833937   47.43391   112.8   13.80311 1.353247          ?        ? 
1 1 1   24   17   14 o 19.83795 3.183368   33.01099    88.4   4.149956 1.263030          ?        ? 
1 1 1   24   17   15 o 6.242084 3.091690   10.43851   164.2  -3.067359 1.443463          ?        ? 
1 1 1   24   17   16 o 29.33385 2.819214   32.13536    72.9   9.202076 1.653968          ?        ? 
1 1 1   24   17   17 o 13.72264 4.713296   18.85160   153.8   2.435844 1.563751          ?        ? 
1 1 1   24   18    0 o 53.92215 1.929447   76.08727     0.0   29.23012 2.074978   29.23012 2.074978 
1 1 1   24   18    1 o 13.56240 3.598412   2.035598   154.2   1.924617 0.9923807          ?        ? 
1 1 1   24   18    2 o 68.39239 1.099250   112.1005   330.5   46.82233 1.503607          ?        ? 
1 1 1   24   18    3 o 87.64375 1.080822   97.90887    59.0   76.89447 1.894545          ?        ? 
1 1 1   24   18    4 o 27.64668 1.849142   32.13428   338.9   7.668397 1.022453          ?        ? 
1 1 1   24   18    5 o 43.49492 1.209940   62.88885   199.2   18.94545 1.052525          ?        ? 
1 1 1   24   18    6 o 34.15887 1.452596   33.46330    18.9   11.69806 0.9923807          ?        ? 
1 1 1   24   18    7 o 47.20100 1.114939   57.75000    83.5   22.31353 1.052525          ?        ? 
1 1 1   24   18    8 o 68.91853 1.025407   91.43523     6.9   47.57413 1.413391          ?        ? 
1 1 1   24   18    9 o 10.14018 3.112870   27.99107    48.0   1.052525 0.6916593          ?        ? 
1 1 1   24   18   10 o 57.73847 0.9635425   76.06803   122.6   33.41015 1.112669          ?        ? 
1 1 1   24   18   11 o 23.45613 2.756427   35.29070   350.4   5.623491 1.293102          ?        ? 
1 1 1   24   18   12 o 30.23193 2.138637   45.48824     7.3   9.292293 1.293102          ?        ? 
1 1 1   24   18   13 o 40.20340 1.683000   45.75451   226.4   16.38932 1.353247          ?        ? 
1 1 1   24   18   14 o 11.01997 3.956639   10.59142   320.9   1.202886 1.112669          ?        ? 
1 1 1   24   18   15 o 8.678151 3.972326   10.07005   212.9 -0.7217315 1.563751          ?        ? 
1 1 1   24   18   16 o 11.89999 4.396856   20.14625   345.0   1.533679 1.383319          ?        ? 
1 1 1   24   18   17 o 27.72899 2.928156   33.47853   149.1   8.510417 1.623896          ?        ? 
1 1 1   24   19    0 o 37.05499 2.124635   40.71441   180.0   13.89333 1.563751   13.89333 1.563751 
1 1 1   24   19    1 o 93.68840 1.091334   96.74867   148.6   87.87081 2.044906          ?        ? 
1 1 1   24   19    2 o 45.58757 1.187382   57.97763   238.8   20.80992 1.082597          ?        ? 
1 1 1   24   19    3 o 15.47193 3.023320   9.856878   352.3   2.495988 0.9021643          ?        ? 
1 1 1   24   19    4 o 27.32192 1.761056   29.87327   118.4   7.487964 0.9623086          ?        ? 
1 1 1   24   19    5 o 60.27673 1.122528   62.05293   129.9   36.38729 1.353247          ?        ? 
1 1 1   24   19    6 o 16.82994 2.680237   6.888100    96.5   2.856854 0.9021643          ?        ? 
1 1 1   24   19    7 o 55.95787 1.047943   83.48686   149.1   31.36525 1.172814          ?        ? 
1 1 1   24   19    8 o 61.74355 1.022803   84.00626   140.2   38.19162 1.263030          ?        ? 
1 1 1   24   19    9 o 44.01324 1.127366   40.28920    81.3   19.42661 0.9923807          ?        ? 
1 1 1   24   19   10 o 12.15657 2.670006   21.02437   142.9   1.563751 0.6315150          ?        ? 
1 1 1   24   19   11 o 19.89316 3.250118   29.38585    86.5   4.089812 1.293102          ?        ? 
1 1 1   24   19   12 o 35.63392 1.898818   43.51733   152.0   12.87088 1.353247          ?        ? 
1 1 1   24   19   13 o 18.54154 3.532941   25.45806   284.1   3.759018 1.263030          ?        ? 
1 1 1   24   19   14 o 17.83727 3.327045   25.93535    75.0   3.488369 1.142741          ?        ? 
1 1 1   24   19   15 o 28.15994 2.883344   35.09208   235.8   8.450273 1.623896          ?        ? 
1 1 1   24   19   16 o 11.49975 4.289953   9.332386    32.1   1.443463 1.323174          ?        ? 
1 1 1   24   20    0 o 18.64217 3.492731   22.77606   180.0   3.819162 1.172814   3.819162 1.172814 
1 1 1   24   20    1 o 24.84155 1.997422   21.97998    12.0   6.194862 0.9923807          ?        ? 
1 1 1   24   20    2 o 19.40714 2.479265   39.81836   307.9   3.789090 0.9623086          ?        ? 
1 1 1   24   20    3 o 21.52574 2.374954   26.72575   357.8   4.661182 1.022453          ?        ? 
1 1 1   24   20    4 o 71.15697 1.056543   80.49838   136.5   50.70164 1.503607          ?        ? 
1 1 1   24   20    5 o 57.31392 1.128088   69.14358   126.1   32.89893 1.293102          ?        ? 
1 1 1   24   20    6 o 5.813685 2.789052   26.95457   303.8  -1.323174 0.9322364          ?        ? 
1 1 1   24   20    7 o 59.71655 1.082700   74.70349    84.2   35.72571 1.293102          ?        ? 
1 1 1   24   20    8 o 17.90553 2.435260   16.27028   317.4   3.247792 0.8720922          ?        ? 
1 1 1   24   20    9 o 6.028508 2.757325   7.681324   270.5 -0.5112265 0.7518036          ?        ? 
1 1 1   24   20   10 o 10.67306 2.984234   17.25467   245.3   1.202886 0.6615872          ?        ? 
1 1 1   24   20   11 o 25.70358 1.286955   27.38856   166.8   6.645944 0.6615872          ?        ? 
1 1 1   24   20   12 o 16.14508 3.864135   18.73982   145.5   2.886926 1.232958          ?        ? 
1 1 1   24   20   13 o 24.58388 2.507655   30.80956    23.2   6.255006 1.232958          ?        ? 
1 1 1   24   20   14 o 19.38016 3.180980   27.03943   356.7   3.999595 1.232958          ?        ? 
1 1 1   24   20   15 o 14.78891 4.755274   12.08069   220.2   2.676421 1.593824          ?        ? 
1 1 1   24   20   16 o 11.38415 4.575892   16.77673    10.7   1.323174 1.593824          ?        ? 
1 1 1   24   21    0 o 21.37363 3.256306   45.96551     0.0   4.811543 1.323174   4.811543 1.323174 
1 1 1   24   21    1 o 31.45807 1.577307   29.87404   290.5   9.923808 0.9923807          ?        ? 
1 1 1   24   21    2 o 13.13196 3.649451   39.73774   114.9   1.804329 0.9923807          ?        ? 
1 1 1   24   21    3 f 21.44558 2.383831   28.94456   169.1   4.631110 1.022453          ?        ? 
1 1 1   24   21    4 o 22.07281 2.247971   29.25867    28.5   4.901759 0.9923807          ?        ? 
1 1 1   24   21    5 o 62.73350 1.102536   78.95152   311.1   39.42458 1.383319          ?        ? 
1 1 1   24   21    6 o 79.14555 1.120882   103.1976    25.4   62.76057 1.774257          ?        ? 
1 1 1   24   21    7 o 40.93428 1.248896   58.22067   322.2   16.81033 1.022453          ?        ? 
1 1 1   24   21    8 o 13.87245 3.205261   16.66504   203.3   2.044906 0.8720922          ?        ? 
1 1 1   24   21    9 o 21.68487 1.941492   39.05487    95.7   4.751399 0.8420200          ?        ? 
1 1 1   24   21   10 o 13.70031 2.730780   15.95506    20.1   1.984761 0.7217315          ?        ? 
1 1 1   24   21   11 o 48.37903 0.9634715   45.16284   285.9   23.48635 0.9322364          ?        ? 
1 1 1   24   21   12 o 13.85793 4.073244   19.26373    67.1   2.135122 1.202886          ?        ? 
1 1 1   24   21   13 o 10.42678 4.147653   12.66356    90.3  0.8119479 1.293102          ?        ? 
1 1 1   24   21   14 f 8.939098 3.885088   5.925881    94.5       0.06 1.293102          ?        ? 
1 1 1   24   21   15 o 30.93142 2.673605   42.73394    67.5   10.19446 1.653968          ?        ? 
1 1 1   24   21   16 o 19.38944 4.227282   25.83293   258.7   4.691255 1.593824          ?        ? 
1 1 1   24   22    0 o 41.56783 1.816086   20.56652   360.0   17.41177 1.503607   17.41177 1.503607 
1 1 1   24   22    1 o 47.29324 1.176351   62.63542   305.2   22.40375 1.112669          ?        ? 
1 1 1   24   22    2 o 27.74703 1.788265   28.23626   244.9   7.728541 0.9923807          ?        ? 
1 1 1   24   22    3 o 17.23903 3.076226   26.07796    99.6   3.097431 1.022453          ?        ? 
1 1 1   24   22    4 f 92.05410 1.094375   99.84119   280.4   84.89366 2.014834          ?        ? 
1 1 1   24   22    5 o 17.32575 2.777106   28.69972   314.4   3.037287 0.9623086          ?        ? 
1 1 1   24   22    6 o 41.44411 1.269813   60.86566   286.6   17.23134 1.052525          ?        ? 
1 1 1   24   22    7 o 45.50482 1.255627   49.90106    38.6   20.77985 1.142741          ?        ? 
1 1 1   24   22    8 o 45.06588 1.234492   69.01167    92.2   20.38891 1.112669          ?        ? 
1 1 1   24   22    9 o 18.45532 2.281239   17.99081    83.8   3.458297 0.8420200          ?        ? 
1 1 1   24   22   10 o 23.00694 1.764572   15.52577   127.0   5.352841 0.8119479          ?        ? 
1 1 1   24   22   11 o 47.14382 1.084398   49.12990   105.0   22.34361 1.022453          ?        ? 
1 1 1   24   22   12 o 8.633382 2.849710   15.29340    33.4  0.7518036 0.5713707          ?        ? 
1 1 1   24   22   13 o 9.540579 3.952406   7.854297   105.8  0.4510822 1.232958          ?        ? 
1 1 1   24   22   14 o 9.465723 3.965595   11.37869   346.3  0.4510822 1.263030          ?        ? 
1 1 1   24   22   15 o 18.13166 4.150990   24.89792    99.0   3.999595 1.473535          ?        ? 
1 1 1   24   23    0 o 42.27619 1.821170   47.29627   180.0   18.01322 1.533679   18.01322 1.533679 
1 1 1   24   23    1 o 30.91894 1.556180   29.87131    80.3   9.593014 0.9623086          ?        ? 
1 1 1   24   23    2 o 42.85382 1.192954   52.05404   105.5   18.40415 1.022453          ?        ? 
1 1 1   24   23    3 o 38.04912 1.462149   45.43280   168.5   14.52485 1.112669          ?        ? 
1 1 1   24   23    4 o 46.97194 1.408473   52.34959    60.4   22.13310 1.323174          ?        ? 
1 1 1   24   23    5 o 15.56009 3.717517   14.47873   345.3   2.586205 1.142741          ?        ? 
1 1 1   24   23    6 o 13.86062 3.868349   36.07538   345.6   2.044906 1.112669          ?        ? 
1 1 1   24   23    7 f 14.77955 3.755323   5.570814   104.8   2.345627 1.112669          ?        ? 
1 1 1   24   23    8 o 22.26711 2.565986   24.53112    92.4   5.052120 1.142741          ?        ? 
1 1 1   24   23    9 o 17.87114 3.231556   35.89293   221.8   3.398152 1.112669          ?        ? 
1 1 1   24   23   10 o 36.05374 1.292843   36.84503    76.2   13.08138 0.9322364          ?        ? 
1 1 1   24   23   11 o 25.77781 1.633227   32.06262    57.0   6.736160 0.8420200          ?        ? 
1 1 1   24   23   12 o 14.16480 2.335322   10.75808   211.6   2.074978 0.6615872          ?        ? 
1 1 1   24   23   13 o 13.74994 4.203556   16.13536   227.4   2.165194 1.263030          ?        ? 
1 1 1   24   23   14 o 15.48287 3.964478   22.50467   292.5   2.826782 1.232958          ?        ? 
1 1 1   24   23   15 f 25.36223 3.319976   23.04487   328.1   7.277459 1.684040          ?        ? 
1 1 1   24   24    0 o 37.44896 1.856649   21.01751   180.0   14.16398 1.383319   14.16398 1.383319 
1 1 1   24   24    1 o 57.94589 1.193630   67.17596   203.4   33.65073 1.383319          ?        ? 
1 1 1   24   24    2 o 17.44182 3.224809   13.87697   137.5   3.187647 1.082597          ?        ? 
1 1 1   24   24    3 o 38.30824 1.491509   40.89210   251.8   14.73535 1.142741          ?        ? 
1 1 1   24   24    4 o 12.55239 4.186157   40.80249   325.2   1.563751 1.232958          ?        ? 
1 1 1   24   24    5 o 41.21050 1.605385   51.86154   264.6   17.08098 1.323174          ?        ? 
1 1 1   24   24    6 o 22.76628 2.509723   31.66574    51.8   5.262625 1.142741          ?        ? 
1 1 1   24   24    7 o 11.01602 4.094118   15.01954    69.7   1.022453 1.202886          ?        ? 
1 1 1   24   24    8 o 17.92355 3.395015   13.25301   124.5   3.428224 1.172814          ?        ? 
1 1 1   24   24    9 o 22.56669 2.731809   31.44570   280.7   5.232553 1.232958          ?        ? 
1 1 1   24   24   10 o 15.63758 3.457555   23.21926   224.5   2.676421 1.052525          ?        ? 
1 1 1   24   24   11 o 14.88856 3.657231   24.65544   291.0   2.465916 1.082597          ?        ? 
1 1 1   24   24   12 o 28.04784 1.983521   34.43048   105.6   8.059335 1.112669          ?        ? 
1 1 1   24   24   13 o 13.21494 2.595683   10.75002   190.5   1.894545 0.6615872          ?        ? 
1 1 1   24   24   14 o 22.22415 3.112197   24.92837   244.4   5.412986 1.383319          ?        ? 
1 1 1   24   24   15 o 7.995950 3.614618   6.409201    25.5 -0.2105050 1.232958          ?        ? 
1 1 1   24   25    0 o 39.22905 2.473287   61.21089   180.0   15.66759 1.924617   15.66759 1.924617 
1 1 1   24   25    1 o 11.28064 3.812095   23.58602   197.7   1.232958 1.022453          ?        ? 
1 1 1   24   25    2 o 21.37049 2.532925   23.42622    49.7   4.631110 1.082597          ?        ? 
1 1 1   24   25    3 o 19.15019 2.748080   34.68675   212.1   3.728946 1.052525          ?        ? 
1 1 1   24   25    4 o 40.94646 1.395410   26.70297   194.3   16.84040 1.142741          ?        ? 
1 1 1   24   25    5 o 17.44782 3.570283   18.13431   225.1   3.247792 1.202886          ?        ? 
1 1 1   24   25    6 o 22.76980 2.707441   28.39527   291.2   5.292697 1.232958          ?        ? 
1 1 1   24   25    7 o 13.23635 3.988827   17.44326    66.0   1.864473 1.142741          ?        ? 
1 1 1   24   25    8 o 50.05597 1.381772   53.98137   198.8   25.23053 1.383319          ?        ? 
1 1 1   24   25    9 o 20.13803 2.986602   22.14169   173.4   4.210100 1.202886          ?        ? 
1 1 1   24   25   10 o 7.685364 3.476740   18.00862   114.4 -0.4811543 1.142741          ?        ? 
1 1 1   24   25   11 o 11.33215 3.967685   10.70761   162.2   1.323174 1.112669          ?        ? 
1 1 1   24   25   12 o 24.21132 2.297829   22.11279   149.5   6.074574 1.112669          ?        ? 
1 1 1   24   25   13 o 10.73031 3.748025   13.46899   149.9   1.232958 0.9923807          ?        ? 
1 1 1   24   25   14 o 18.27273 2.139460   21.41436   174.7   3.518441 0.7818757          ?        ? 
1 1 1   24   26    0 o 38.31446 2.534231   39.41184    -0.0   14.97593 1.924617   14.97593 1.924617 
1 1 1   24   26    1 o 57.35891 1.415557   83.42558   350.2   33.04929 1.623896          ?        ? 
1 1 1   24   26    2 o 10.40789 4.037364   22.01572   154.9  0.7518036 1.202886          ?        ? 
1 1 1   24   26    3 o 15.81370 3.598026   13.75976   145.6   2.676421 1.112669          ?        ? 
1 1 1   24   26    4 f 21.48705 2.449208   16.52381   113.1   4.691255 1.052525          ?        ? 
1 1 1   24   26    5 o 26.54704 1.982377   28.83974   191.2   7.127099 1.052525          ?        ? 
1 1 1   24   26    6 o 21.38413 2.882881   13.57651   230.3   4.691255 1.232958          ?        ? 
1 1 1   24   26    7 o 38.42468 1.682646   41.98757   126.0   14.91578 1.293102          ?        ? 
1 1 1   24   26    8 o 6.524747 3.129721   2.785970   176.6  -1.563751 1.172814          ?        ? 
1 1 1   24   26    9 o 10.75142 4.033278   12.50681   161.5   1.022453 1.172814          ?        ? 
1 1 1   24   26   10 o 16.23652 3.693827   18.32211   336.7   2.947070 1.172814          ?        ? 
1 1 1   24   26   11 o 34.62199 1.824029   35.28350   115.7   12.23936 1.263030          ?        ? 
1 1 1   24   26   12 o 18.68145 2.897519   20.45218    16.9   3.728946 1.082597          ?        ? 
1 1 1   24   26   13 o 23.89565 2.328184   16.41289    46.7   6.014429 1.112669          ?        ? 
1 1 1   24   26   14 o 15.74313 3.167607   24.04320   340.5   2.856854 0.9623086          ?        ? 
1 1 1   24   27    0 f 31.28010 2.881895   14.30463     0.0   10.13431 1.774257   10.13431 1.774257 
1 1 1   24   27    1 o 14.48738 4.081468   20.95906     7.1   2.255411 1.232958          ?        ? 
1 1 1   24   27    2 o 39.71968 1.741351   42.65617   284.3   15.90816 1.383319          ?        ? 
1 1 1   24   27    3 o 44.07769 1.637408   59.20047   326.3   19.57697 1.443463          ?        ? 
1 1 1   24   27    4 o 55.36489 1.249274   65.62867    80.0   30.79388 1.383319          ?        ? 
1 1 1   24   27    5 o 17.53992 3.293155   17.70359    39.9   3.277864 1.112669          ?        ? 
1 1 1   24   27    6 o 29.58449 1.931319   28.33894    76.8   8.871283 1.142741          ?        ? 
1 1 1   24   27    7 o 36.34643 1.820226   47.17110    39.9   13.38210 1.323174          ?        ? 
1 1 1   24   27    8 o 25.22057 2.265495   23.86023    51.8   6.525656 1.142741          ?        ? 
1 1 1   24   27    9 o 10.96979 4.167088   17.10427   337.4   1.052525 1.263030          ?        ? 
1 1 1   24   27   10 o 26.38822 2.279210   25.61928   318.2   7.187243 1.202886          ?        ? 
1 1 1   24   27   11 o 20.35046 2.881541   21.18912   329.7   4.390533 1.172814          ?        ? 
1 1 1   24   27   12 o 16.02196 3.726954   27.11444   252.2   2.977142 1.172814          ?        ? 
1 1 1   24   27   13 o 7.621084 3.418789   13.98852   150.0 -0.1804329 1.082597          ?        ? 
1 1 1   24   28    0 o 28.94105 3.570263   27.85176   180.0   8.901355 2.014834   8.901355 2.014834 
1 1 1   24   28    1 o 33.59558 2.058780   44.57096    29.8   11.42741 1.383319          ?        ? 
1 1 1   24   28    2 o 26.50527 2.496059   28.66350   197.6   7.157170 1.323174          ?        ? 
1 1 1   24   28    3 o 39.95001 1.768949   54.93192    31.7   16.11867 1.413391          ?        ? 
1 1 1   24   28    4 o 22.23488 2.840199   36.64819   183.1   5.082192 1.263030          ?        ? 
1 1 1   24   28    5 o 41.45898 1.450694   52.94513   168.1   17.32155 1.202886          ?        ? 
1 1 1   24   28    6 o 28.66044 2.098512   29.64494   182.5   8.360056 1.202886          ?        ? 
1 1 1   24   28    7 o 28.43888 2.114862   28.24556   228.2   8.269840 1.202886          ?        ? 
1 1 1   24   28    8 o 32.57541 2.077098   32.73991   231.9   10.85604 1.353247          ?        ? 
1 1 1   24   28    9 o 23.36093 2.574568   29.15512   218.5   5.683635 1.202886          ?        ? 
1 1 1   24   28   10 o 28.96842 2.180012   39.69978   214.4   8.660777 1.263030          ?        ? 
1 1 1   24   28   11 o 20.30957 3.035411   19.17598   206.7   4.450677 1.232958          ?        ? 
1 1 1   24   28   12 o 13.37628 4.104892   19.46714   195.8   2.165194 1.202886          ?        ? 
1 1 1   24   28   13 o 21.68001 2.635472   22.46855   273.3   5.112265 1.142741          ?        ? 
1 1 1   24   29    0 o 12.56379 6.090963   14.01714   360.0   2.465916 1.774257   2.465916 1.774257 
1 1 1   24   29    1 o 77.85515 1.274650   105.6433   177.6   60.95624 1.984761          ?        ? 
1 1 1   24   29    2 o 27.26774 2.315979   34.91794     3.3   7.578181 1.263030          ?        ? 
1 1 1   24   29    3 o 20.69418 3.269631   11.90591   176.7   4.450677 1.353247          ?        ? 
1 1 1   24   29    4 o 23.76298 2.720834   29.99042   170.0   5.803924 1.293102          ?        ? 
1 1 1   24   29    5 o 8.530472 3.750015   7.564160   344.5 -0.1804329 1.232958          ?        ? 
1 1 1   24   29    6 o 13.68149 3.814855   26.74706   296.0   2.074978 1.082597          ?        ? 
1 1 1   24   29    7 o 18.39303 3.024704   26.21997    99.1   3.548513 1.112669          ?        ? 
1 1 1   24   29    8 o 21.74104 2.628075   22.78341    72.6   4.931832 1.142741          ?        ? 
1 1 1   24   29    9 o 13.26316 4.111965   20.44055    92.6   1.984761 1.202886          ?        ? 
1 1 1   24   29   10 o 6.570005 3.174192   9.549020     9.1  -1.714112 1.263030          ?        ? 
1 1 1   24   29   11 o 11.42745 4.019021   7.529148    10.6   1.443463 1.142741          ?        ? 
1 1 1   24   29   12 o 9.029324 3.880486   4.948997   218.4  0.3608657 1.263030          ?        ? 
1 1 1   24   30    0 o 32.49744 2.912884   19.20056   180.0   10.97633 1.864473   10.97633 1.864473 
1 1 1   24   30    1 o 41.18973 1.788717   56.63444   212.1   17.17119 1.473535          ?        ? 
1 1 1   24   30    2 o 21.08038 2.995748   23.46989    83.3   4.601038 1.263030          ?        ? 
1 1 1   24   30    3 f 12.76650 4.236900   21.01455   321.6   1.714112 1.263030          ?        ? 
1 1 1   24   30    4 f 25.31752 2.553770   41.70707   334.7   6.615872 1.293102          ?        ? 
1 1 1   24   30    5 o 11.70947 4.259320   17.17206   245.0   1.323174 1.293102          ?        ? 
1 1 1   24   30    6 o 12.82681 4.287043   11.50875   316.3   1.774257 1.293102          ?        ? 
1 1 1   24   30    7 o 6.982843 3.270375   6.752451   256.9 -0.9623086 1.142741          ?        ? 
1 1 1   24   30    8 o 44.88831 1.440355   46.65470   208.1   20.41899 1.293102          ?        ? 
1 1 1   24   30    9 o 17.21976 3.350341   15.31598   228.4   3.307936 1.112669          ?        ? 
1 1 1   24   30   10 o 32.31274 1.861318   26.42136   227.2   10.76583 1.202886          ?        ? 
1 1 1   24   30   11 o 14.00703 4.306631   11.04898    92.1   2.465916 1.323174          ?        ? 
1 1 1   24   30   12 o 11.53507 4.162695   17.33497   360.0   1.593824 1.232958          ?        ? 
1 1 1   24   31    0 o 26.38228 3.759820   27.44532   180.0   7.427820 1.924617   7.427820 1.924617 
1 1 1   24   31    1 o 33.34370 2.119427   46.01658   317.5   11.36727 1.413391          ?        ? 
1 1 1   24   31    2 o 11.24552 4.336334   13.43807   331.9   1.052525 1.383319          ?        ? 
1 1 1   24   31    3 o 10.74636 4.313427   11.02797    92.5  0.7818757 1.413391          ?        ? 
1 1 1   24   31    4 o 23.11313 2.797333   26.90505   245.2   5.563347 1.293102          ?        ? 
1 1 1   24   31    5 o 17.39605 3.820533   25.39425   117.8   3.398152 1.293102          ?        ? 
1 1 1   24   31    6 o 10.95624 4.200470   18.84603   265.7   1.052525 1.293102          ?        ? 
1 1 1   24   31    7 o 34.16262 1.980595   34.59393   209.7   11.96871 1.353247          ?        ? 
1 1 1   24   31    8 o 23.66272 2.478189   17.75222    54.7   5.864068 1.172814          ?        ? 
1 1 1   24   31    9 o 38.49196 1.679704   40.11595   124.9   15.18643 1.293102          ?        ? 
1 1 1   24   31   10 o 24.81881 2.423335   31.43327    60.4   6.555727 1.202886          ?        ? 
1 1 1   24   31   11 o 17.86422 3.404903   22.65411   277.6   3.728946 1.172814          ?        ? 
1 1 1   24   32    0 o 30.26551 3.402845   23.97864   180.0   9.773447 2.014834   9.773447 2.014834 
1 1 1   24   32    1 o 20.38410 3.245604   13.71778   243.5   4.390533 1.323174          ?        ? 
1 1 1   24   32    2 o 25.84255 2.676437   32.28991   333.3   6.946666 1.383319          ?        ? 
1 1 1   24   32    3 o 24.33508 2.904019   26.92144   136.0   6.224934 1.413391          ?        ? 
1 1 1   24   32    4 o 38.61101 2.063950   42.64940    78.9   15.30672 1.593824          ?        ? 
1 1 1   24   32    5 o 16.91083 3.974903   22.72475   236.4   3.247792 1.323174          ?        ? 
1 1 1   24   32    6 o 20.82480 3.176919   22.54731    89.0   4.631110 1.323174          ?        ? 
1 1 1   24   32    7 o 21.34175 3.240875   24.42872    52.9   4.931832 1.383319          ?        ? 
1 1 1   24   32    8 f 22.77842 2.970458   27.39832     7.2   5.593419 1.353247          ?        ? 
1 1 1   24   32    9 o 16.27620 3.844267   24.26643    92.6   3.157575 1.232958          ?        ? 
1 1 1   24   32   10 f 14.02512 3.990170   16.59665   230.3   2.435844 1.172814          ?        ? 
1 1 1   24   33    0 f 8.886297 5.416528   9.769880   180.0  0.9923807 1.774257  0.9923807 1.774257 
1 1 1   24   33    1 o 20.82356 3.465936   22.27544   305.2   4.661182 1.443463          ?        ? 
1 1 1   24   33    2 o 23.18967 3.177136   22.46230   290.1   5.713707 1.473535          ?        ? 
1 1 1   24   33    3 o 8.020826 3.640117   5.699530   185.5 -0.5112265 1.263030          ?        ? 
1 1 1   24   33    4 o 35.01366 2.147172   31.29085   230.7   12.63030 1.503607          ?        ? 
1 1 1   24   33    5 o 29.68571 2.380591   25.46928    82.9   9.172004 1.413391          ?        ? 
1 1 1   24   33    6 o 11.57366 4.295424   19.58047    21.4   1.383319 1.323174          ?        ? 
1 1 1   24   33    7 o 14.42420 4.281216   22.36978    72.9   2.495988 1.323174          ?        ? 
1 1 1   24   33    8 o 10.12037 4.239608   8.083875   269.4  0.6916593 1.443463          ?        ? 
1 1 1   24   33    9 f 12.43870 4.082784   19.37856     4.4   1.894545 1.172814          ?        ? 
1 1 1   24   34    0 f 7.857067 5.091059   11.39944   180.0  0.3007214 1.834401  0.3007214 1.834401 
1 1 1   24   34    1 o 12.46293 4.417953   9.710742   312.5   1.653968 1.383319          ?        ? 
1 1 1   24   34    2 o 7.880983 3.688244   10.33155   158.9  -1.082597 1.443463          ?        ? 
1 1 1   24   34    3 o 19.91400 3.761498   19.61053    84.1   4.480750 1.443463          ?        ? 
1 1 1   24   34    4 o 12.90017 4.602701   13.70370   189.8   1.864473 1.503607          ?        ? 
1 1 1   24   34    5 f 17.95334 3.801421   21.66524    80.2   3.728946 1.323174          ?        ? 
1 1 1   24   34    6 o 44.07478 1.739860   43.21910    75.6   19.96791 1.533679          ?        ? 
1 1 1   24   34    7 o 29.38574 2.302556   29.52287    27.1   9.141932 1.353247          ?        ? 
1 1 1   24   34    8 o 16.17412 4.362002   14.43667    42.1   3.338008 1.443463          ?        ? 
1 1 1   24   35    0 o 9.271259 5.646521  0.9330566   360.0   1.202886 1.924617   1.202886 1.924617 
1 1 1   24   35    1 o 10.30312 4.157722   9.853573   317.7  0.8119479 1.323174          ?        ? 
1 1 1   24   35    2 o 9.614040 4.162376   5.946474   128.8  0.2405772 1.473535          ?        ? 
1 1 1   24   35    3 o 11.36343 4.382921   17.24926   340.7   1.263030 1.413391          ?        ? 
1 1 1   24   35    4 o 23.23827 3.170493   24.83453    43.9   5.894140 1.473535          ?        ? 
1 1 1   24   35    5 o 28.83673 2.502821   27.00646   307.9   8.841210 1.443463          ?        ? 
1 1 1   24   35    6 o 34.30401 2.323087   38.98606   203.9   12.51001 1.593824          ?        ? 
1 1 1   24   35    7 o 17.87681 4.119171   17.54064   115.6   3.969523 1.443463          ?        ? 
1 1 1   24   36    0 o 8.540055 5.546884   2.660611     0.0  0.5412986 2.195267  0.5412986 2.195267 
1 1 1   24   36    1 o 21.07592 3.424437   20.59648    74.7   4.931832 1.443463          ?        ? 
1 1 1   24   36    2 o 7.601861 3.587207   3.511491   316.8  -1.202886 1.443463          ?        ? 
1 1 1   24   36    3 o 10.34112 4.252075   22.07269   240.6  0.8420200 1.413391          ?        ? 
1 1 1   24   36    4 o 8.073210 3.728173   7.918830     6.8 -0.6014429 1.413391          ?        ? 
1 1 1   24   36    5 o 28.93049 2.598655   34.19139    51.3   9.051716 1.503607          ?        ? 
1 1 1   24   36    6 o 16.15800 4.363956   18.33805   289.7   3.368080 1.443463          ?        ? 
1 1 1   24   37    0 o 11.59165 6.433790  0.9415286   180.0   2.556132 2.165194   2.556132 2.165194 
1 1 1   24   37    1 o 23.11595 3.252316   29.86446   122.3   6.014429 1.503607          ?        ? 
1 1 1   24   37    2 o 30.06981 2.650206   29.52713   140.1   9.803518 1.593824          ?        ? 
1 1 1   24   37    3 o 13.70558 4.622843   18.02657   297.2   2.435844 1.503607          ?        ? 
1 1 1   24   37    4 o 15.72809 4.349858   31.78958   346.6   3.187647 1.413391          ?        ? 
1 1 1   24   38    0 f 6.431682 4.539551   8.380744   180.0  -1.413391 2.165194  -1.413391 2.165194 
1 1 1   24   38    1 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   25    0    1 o 8.659395 4.675766   8.467778    90.0   1.082597 1.112669   1.082597 1.112669 
1 1 1   25    0    2 o 69.61662 1.275261   133.9681   270.0   48.53644 1.774257   48.53644 1.774257 
1 1 1   25    0    3 o 20.68806 2.690938   9.265863    90.0   4.360461 1.112669   4.360461 1.112669 
1 1 1   25    0    4 o 12.98127 4.595202   4.975017    90.0   2.225339 1.082597   2.225339 1.082597 
1 1 1   25    0    5 o 92.69169 1.282056   135.7741   270.0   86.00633 2.375700   86.00633 2.375700 
1 1 1   25    0    6 o 107.0939 1.362382   146.2710   270.0   114.8154 2.916998   114.8154 2.916998 
1 1 1   25    0    7 o 49.59841 1.244679   69.97520   270.0   24.65916 1.232958   24.65916 1.232958 
1 1 1   25    0    8 o 89.85904 1.188506   127.5028   270.0   80.83392 2.135122   80.83392 2.135122 
1 1 1   25    0    9 o 74.84489 1.085352   69.98795    90.0   56.08455 1.623896   56.08455 1.623896 
1 1 1   25    0   10 o 45.53217 1.356596   43.21837    90.0   20.80992 1.232958   20.80992 1.232958 
1 1 1   25    0   11 o 27.37749 4.237314   37.09373    90.0   7.969118 2.195267   7.969118 2.195267 
1 1 1   25    0   12 o 15.79744 7.787154   17.15997   270.0   3.909379 2.916998   3.909379 2.916998 
1 1 1   25    0   13 x        ?      ?   37.82765   270.0          ?        ?          ?        ? 
1 1 1   25    0   14 o 26.60133 5.349949   49.73526   270.0   8.119479 2.526060   8.119479 2.526060 
1 1 1   25    0   15 o 8.503522 5.350039   10.19277   270.0  0.6014429 1.864473  0.6014429 1.864473 
1 1 1   25    0   16 x        ?      ?   35.14737   270.0          ?        ?          ?        ? 
1 1 1   25    0   17 x        ?      ?   33.13641    90.0          ?        ?          ?        ? 
1 1 1   25    0   18 x        ?      ?   16.95042    90.0          ?        ?          ?        ? 
1 1 1   25    0   19 o 15.36987 7.874248   22.92889    90.0   4.991976 3.037287   4.991976 3.037287 
1 1 1   25    1    0 o 28.13828 2.107518   59.00019   360.0   8.059335 1.172814   8.059335 1.172814 
1 1 1   25    1    1 o 79.22327 0.8920301   109.8495   166.3   62.79064 1.413391          ?        ? 
1 1 1   25    1    2 o 14.34734 2.718684   3.819932    53.6   2.135122 0.7518036          ?        ? 
1 1 1   25    1    3 o 25.99444 1.503929   26.29077   314.0   6.766232 0.7818757          ?        ? 
1 1 1   25    1    4 o 74.30882 0.8903213   97.99220   327.4   55.24253 1.323174          ?        ? 
1 1 1   25    1    5 o 50.27770 0.9270874   56.32646    96.9   25.29067 0.9322364          ?        ? 
1 1 1   25    1    6 o 91.27746 0.9060113   146.9941   305.9   83.35999 1.653968          ?        ? 
1 1 1   25    1    7 o 83.79361 0.8613205   101.8241   252.0   70.24854 1.443463          ?        ? 
1 1 1   25    1    8 o 48.60414 0.8352662   93.80915   346.6   23.63671 0.8119479          ?        ? 
1 1 1   25    1    9 o 50.42455 0.7752928   69.75266   136.8   25.44103 0.7818757          ?        ? 
1 1 1   25    1   10 o 58.64191 1.025620   109.0561   231.4   34.43261 1.202886          ?        ? 
1 1 1   25    1   11 o 62.20747 1.063517   92.63567   165.6   38.76299 1.323174          ?        ? 
1 1 1   25    1   12 o 57.86781 1.792860   63.96638   222.8   33.71087 2.074978          ?        ? 
1 1 1   25    1   13 o 13.23101 5.777725   40.59155    94.6 -0.1202886 2.886926          ?        ? 
1 1 1   25    1   14 o 34.17476 3.299819   48.28828    31.6   12.08900 2.255411          ?        ? 
1 1 1   25    1   15 o 29.13765 4.592719   30.32073   186.0   9.262220 2.676421          ?        ? 
1 1 1   25    1   16 o 26.35128 5.206584   32.95863    78.9   8.209695 2.646349          ?        ? 
1 1 1   25    1   17 o 14.24233 5.527649   23.98226    91.5   2.135122 2.255411          ?        ? 
1 1 1   25    1   18 o 20.43760 7.037733   23.77244    79.8   6.676016 3.488369          ?        ? 
1 1 1   25    1   19 o 10.64879 4.818011   10.96694   107.7  0.3307936 2.195267          ?        ? 
1 1 1   25    2    0 o 26.12542 2.397559   34.66244   180.0   7.006810 1.232958   7.006810 1.232958 
1 1 1   25    2    1 o 67.52567 0.9352223   107.2312    22.5   45.61944 1.263030          ?        ? 
1 1 1   25    2    2 o 19.67298 1.987182   25.91451    37.8   3.879307 0.7818757          ?        ? 
1 1 1   25    2    3 o 122.2240 1.070280   147.3240   283.0   149.4886 2.616277          ?        ? 
1 1 1   25    2    4 o 48.20131 0.9670241   55.60345   219.5   23.24577 0.9322364          ?        ? 
1 1 1   25    2    5 o 63.44142 0.9006273   59.39198   158.8   40.26660 1.142741          ?        ? 
1 1 1   25    2    6 o 64.91437 0.9033545   100.0962   130.7   42.16114 1.172814          ?        ? 
1 1 1   25    2    7 o 90.16511 0.9338646   126.7816   176.9   81.34515 1.684040          ?        ? 
1 1 1   25    2    8 o 32.14281 1.263032   33.31196   216.5   10.34482 0.8119479          ?        ? 
1 1 1   25    2    9 o 62.13237 1.016403   68.12135   233.7   38.64271 1.263030          ?        ? 
1 1 1   25    2   10 o 26.66429 1.409757   45.33026   233.9   7.127099 0.7518036          ?        ? 
1 1 1   25    2   11 o 47.80048 1.384060   83.79504   225.1   22.91497 1.323174          ?        ? 
1 1 1   25    2   12 o 57.79587 1.170712   72.95370   232.8   33.50037 1.353247          ?        ? 
1 1 1   25    2   13 o 43.17873 1.950081   65.35974   253.0   18.82516 1.684040          ?        ? 
1 1 1   25    2   14 o 28.13966 3.847230   34.39788    73.4   8.299912 2.165194          ?        ? 
1 1 1   25    2   15 o 37.85196 2.979252   57.30917   103.5   14.88571 2.255411          ?        ? 
1 1 1   25    2   16 o 19.93996 7.048155   20.02744   190.6   5.262625 3.518441          ?        ? 
1 1 1   25    2   17 o 9.775106 4.316466   12.61955   222.5      -0.06 1.653968          ?        ? 
1 1 1   25    2   18 o 11.17431 4.691611   18.83913   246.6  0.9021643 1.774257          ?        ? 
1 1 1   25    2   19 x        ?      ?   3.120115    19.3          ?        ?          ?        ? 
1 1 1   25    3    0 o 53.80864 1.315093   91.04443   360.0   29.01962 1.413391   29.01962 1.413391 
1 1 1   25    3    1 o 57.31665 0.9444004   69.32732   329.7   32.86885 1.082597          ?        ? 
1 1 1   25    3    2 o 90.91449 0.9427058   144.4724   228.3   82.69839 1.714112          ?        ? 
1 1 1   25    3    3 o 104.4503 0.9932846   149.1471   221.6   109.1619 2.074978          ?        ? 
1 1 1   25    3    4 o 35.52532 1.185099   50.87958   187.1   12.63030 0.8420200          ?        ? 
1 1 1   25    3    5 o 76.34370 0.8862856   86.88494   290.9   58.30989 1.353247          ?        ? 
1 1 1   25    3    6 o 56.84134 0.9258447   80.51112   348.2   32.32756 1.052525          ?        ? 
1 1 1   25    3    7 o 83.47681 1.062724   96.99760   354.7   69.73730 1.774257          ?        ? 
1 1 1   25    3    8 o 29.66090 1.368718   53.25161    19.4   8.811138 0.8119479          ?        ? 
1 1 1   25    3    9 o 100.8107 1.178297   150.9099   308.6   101.7641 2.375700          ?        ? 
1 1 1   25    3   10 o 33.27410 1.355656   60.40807    21.7   11.09662 0.9021643          ?        ? 
1 1 1   25    3   11 o 17.57127 2.909445   4.812801    55.9   3.127503 1.022453          ?        ? 
1 1 1   25    3   12 f 23.36524 1.930569   42.78476   339.2   5.503202 0.9021643          ?        ? 
1 1 1   25    3   13 o 17.31314 2.258041   20.96704   240.6   3.037287 0.7818757          ?        ? 
1 1 1   25    3   14 o 27.20950 0.9946868   40.59904   309.6   7.427820 0.5412986          ?        ? 
1 1 1   25    3   15 o 23.08240 3.322184   30.22379   215.8   5.593419 1.533679          ?        ? 
1 1 1   25    3   16 o 8.090732 3.931833   20.49272    90.0  -2.947070 2.014834          ?        ? 
1 1 1   25    3   17 o 23.45223 5.080004   33.53180   337.6   6.676016 2.315555          ?        ? 
1 1 1   25    3   18 o 11.02005 4.318303   6.193002    15.9   1.172814 1.383319          ?        ? 
1 1 1   25    4    0 o 52.53034 1.376024   80.64838   360.0   27.66637 1.443463   27.66637 1.443463 
1 1 1   25    4    1 o 100.3719 0.9737235   156.5346    29.8   100.8018 1.954689          ?        ? 
1 1 1   25    4    2 f 70.03591 0.9661090   102.7349    74.8   49.07774 1.353247          ?        ? 
1 1 1   25    4    3 o 67.25742 0.9389521   90.49928    85.8   45.25858 1.263030          ?        ? 
1 1 1   25    4    4 o 15.77200 2.478683   10.38705    74.4   2.495988 0.7818757          ?        ? 
1 1 1   25    4    5 f 83.82628 0.9865450   102.9766   336.3   70.30868 1.653968          ?        ? 
1 1 1   25    4    6 o 72.64357 1.014223   103.9067   293.6   52.80669 1.473535          ?        ? 
1 1 1   25    4    7 o 45.86335 1.049104   47.26289   111.3   21.05050 0.9623086          ?        ? 
1 1 1   25    4    8 o 29.45856 1.327078   73.55748   175.9   8.690849 0.7818757          ?        ? 
1 1 1   25    4    9 o 60.28179 1.172320   97.21955   163.9   36.38729 1.413391          ?        ? 
1 1 1   25    4   10 o 35.66319 1.433485   53.11134   355.6   12.75059 1.022453          ?        ? 
1 1 1   25    4   11 o 20.15568 2.088791   18.92550    50.3   4.089812 0.8420200          ?        ? 
1 1 1   25    4   12 o 61.12331 1.303777   76.20627   121.8   37.49996 1.593824          ?        ? 
1 1 1   25    4   13 o 41.02071 1.722777   49.92798    92.5   16.96069 1.413391          ?        ? 
1 1 1   25    4   14 o 9.149423 3.635399   9.782549    30.1  0.5112265 0.9923807          ?        ? 
1 1 1   25    4   15 o 16.24919 2.313357   9.730776     4.8   2.706493 0.7518036          ?        ? 
1 1 1   25    4   16 o 9.704062 3.268843   13.06223   167.6  0.9623086 0.7518036          ?        ? 
1 1 1   25    4   17 o 8.016872 3.123729   18.14780   154.7  0.4811543 0.7217315          ?        ? 
1 1 1   25    4   18 o 13.86382 2.809413   25.43796    72.5   2.135122 0.7518036          ?        ? 
1 1 1   25    5    0 o 35.02780 1.638872   61.95832   180.0   12.35965 1.142741   12.35965 1.142741 
1 1 1   25    5    1 o 38.99268 1.156838   70.60780   153.5   15.21651 0.9021643          ?        ? 
1 1 1   25    5    2 o 96.23106 0.9374981   134.1476   120.5   92.65228 1.804329          ?        ? 
1 1 1   25    5    3 o 37.97684 1.227375   56.51129   199.3   14.43463 0.9322364          ?        ? 
1 1 1   25    5    4 f 71.31230 0.9909867   100.0720   275.7   50.88207 1.413391          ?        ? 
1 1 1   25    5    5 o 35.73032 1.346628   38.37562   201.2   12.78066 0.9623086          ?        ? 
1 1 1   25    5    6 o 29.86301 1.510505   45.61263    80.0   8.931427 0.9021643          ?        ? 
1 1 1   25    5    7 o 52.89037 1.080292   80.07139   147.8   27.99717 1.142741          ?        ? 
1 1 1   25    5    8 o 85.79945 0.9813818   117.2086   159.0   73.67676 1.684040          ?        ? 
1 1 1   25    5    9 o 9.089426 3.548416   21.93094   268.3  0.5112265 0.9322364          ?        ? 
1 1 1   25    5   10 o 28.23021 1.757658   52.72514   265.2   7.999191 0.9923807          ?        ? 
1 1 1   25    5   11 o 26.11263 1.900193   28.26028    68.2   6.856449 0.9923807          ?        ? 
1 1 1   25    5   12 o 34.66629 1.951819   30.15800    44.8   12.11907 1.353247          ?        ? 
1 1 1   25    5   13 o 51.12090 1.441226   63.74522   211.8   26.28305 1.473535          ?        ? 
1 1 1   25    5   14 o 21.19672 2.624626   17.59596   315.4   4.601038 1.112669          ?        ? 
1 1 1   25    5   15 o 13.14882 4.287046   10.32505   337.0   1.864473 1.293102          ?        ? 
1 1 1   25    5   16 o 17.96347 2.343701   24.18457   163.7   3.338008 0.8420200          ?        ? 
1 1 1   25    5   17 o 10.42638 3.685956   20.62719   218.3   1.112669 0.9623086          ?        ? 
1 1 1   25    5   18 o 7.155881 3.216288   4.893106   107.4 -0.2405772 0.9623086          ?        ? 
1 1 1   25    6    0 o 15.83826 3.837007   27.86853   360.0   2.916998 1.052525   2.916998 1.052525 
1 1 1   25    6    1 o 79.48212 1.002630   111.9353   227.3   63.21165 1.593824          ?        ? 
1 1 1   25    6    2 o 29.96774 1.455052   32.75287   288.0   8.991571 0.8720922          ?        ? 
1 1 1   25    6    3 o 60.77279 1.113365   67.57403   205.0   36.95867 1.353247          ?        ? 
1 1 1   25    6    4 o 30.31728 1.438276   42.52188   100.6   9.202076 0.8720922          ?        ? 
1 1 1   25    6    5 o 20.34380 2.069476   36.88650    20.4   4.149956 0.8420200          ?        ? 
1 1 1   25    6    6 o 73.15816 1.027641   114.4984    82.1   53.55849 1.503607          ?        ? 
1 1 1   25    6    7 o 87.07117 1.018854   125.0018   344.6   75.87202 1.774257          ?        ? 
1 1 1   25    6    8 o 34.85880 1.595966   60.24787    79.7   12.17922 1.112669          ?        ? 
1 1 1   25    6    9 o 22.27661 2.429896   26.72867   227.4   4.991976 1.082597          ?        ? 
1 1 1   25    6   10 o 31.35054 1.726601   34.96648    55.0   9.863664 1.082597          ?        ? 
1 1 1   25    6   11 o 59.86592 1.105115   93.39561    19.7   35.90614 1.323174          ?        ? 
1 1 1   25    6   12 o 32.09699 1.780138   24.60453   334.0   10.37489 1.142741          ?        ? 
1 1 1   25    6   13 o 9.737914 3.982225   7.126627   141.9  0.4210100 1.232958          ?        ? 
1 1 1   25    6   14 o 22.54402 2.867950   34.09612   261.3   5.232553 1.293102          ?        ? 
1 1 1   25    6   15 o 52.65522 1.741898   66.19223   359.7   28.14753 1.834401          ?        ? 
1 1 1   25    6   16 o 14.95334 4.534186   24.66159   254.6   2.586205 1.473535          ?        ? 
1 1 1   25    6   17 o 22.93434 2.425771   32.70437   214.3   5.503202 1.112669          ?        ? 
1 1 1   25    6   18 o 7.458232 3.357289   6.456065    66.3 -0.2405772 1.052525          ?        ? 
1 1 1   25    7    0 o 31.33964 2.229673   42.04449   180.0   9.983953 1.383319   9.983953 1.383319 
1 1 1   25    7    1 o 30.06923 1.400136   53.45137   317.9   9.051716 0.8420200          ?        ? 
1 1 1   25    7    2 o 60.99491 1.109311   93.18787   272.5   37.22932 1.353247          ?        ? 
1 1 1   25    7    3 o 43.02326 1.188256   76.43595   356.6   18.52444 1.022453          ?        ? 
1 1 1   25    7    4 o 11.26920 3.355508   32.09961   332.0   1.293102 0.8119479          ?        ? 
1 1 1   25    7    5 o 23.04222 1.957633   42.83009   290.1   5.322770 0.9021643          ?        ? 
1 1 1   25    7    6 o 64.14214 0.9845557   87.94273   130.7   41.16877 1.263030          ?        ? 
1 1 1   25    7    7 f 7.180835 3.099082   7.679668   345.1      -0.09 0.8119479          ?        ? 
1 1 1   25    7    8 o 82.49651 1.166484   92.47108    11.0   68.14348 1.924617          ?        ? 
1 1 1   25    7    9 o 24.39850 2.218573   40.41409   120.1   5.984357 1.082597          ?        ? 
1 1 1   25    7   10 o 64.58787 1.280401   99.27016   283.6   41.80028 1.653968          ?        ? 
1 1 1   25    7   11 o 83.22976 1.228470   116.0588   249.5   69.43658 2.044906          ?        ? 
1 1 1   25    7   12 o 7.306431 3.443881   15.43552   351.4  -1.443463 1.323174          ?        ? 
1 1 1   25    7   13 o 41.83637 1.725129   48.74710   110.0   17.65235 1.443463          ?        ? 
1 1 1   25    7   14 o 39.25515 1.723655   62.47762   220.6   15.57737 1.353247          ?        ? 
1 1 1   25    7   15 o 19.75470 3.788611   24.96562   175.4   4.300317 1.443463          ?        ? 
1 1 1   25    7   16 o 26.72654 2.531653   32.51245    60.9   7.427820 1.353247          ?        ? 
1 1 1   25    7   17 o 8.303665 3.527343   2.962723    89.9  0.2105050 1.022453          ?        ? 
1 1 1   25    7   18 o 18.82504 3.115037   28.06899   298.2   3.939451 1.172814          ?        ? 
1 1 1   25    8    0 o 52.75410 1.685410   65.25582   180.0   27.93702 1.774257   27.93702 1.774257 
1 1 1   25    8    1 o 32.79050 1.513214   63.55485   101.4   10.76583 0.9923807          ?        ? 
1 1 1   25    8    2 o 57.49172 1.203059   62.20410   153.7   33.07936 1.383319          ?        ? 
1 1 1   25    8    3 o 14.98441 3.204110   19.66754   355.3   2.345627 0.9322364          ?        ? 
1 1 1   25    8    4 o 50.94969 1.209976   82.97680   160.9   25.98233 1.232958          ?        ? 
1 1 1   25    8    5 o 126.7709 1.292830   172.0287    28.4   160.8860 3.277864          ?        ? 
1 1 1   25    8    6 o 76.10830 1.165613   88.17383    14.9   57.97910 1.774257          ?        ? 
1 1 1   25    8    7 o 29.40971 1.278156   35.37474    10.3   8.660777 0.7518036          ?        ? 
1 1 1   25    8    8 o 27.85200 2.051453   34.15792   325.5   7.788685 1.142741          ?        ? 
1 1 1   25    8    9 o 81.87105 1.248858   104.4306    34.6   67.15110 2.044906          ?        ? 
1 1 1   25    8   10 o 51.15068 1.293408   85.70224   129.4   26.22291 1.323174          ?        ? 
1 1 1   25    8   11 o 36.27558 1.782332   61.83226   339.0   13.23174 1.293102          ?        ? 
1 1 1   25    8   12 o 42.02342 1.431209   55.95229    14.2   17.74257 1.202886          ?        ? 
1 1 1   25    8   13 o 10.65024 4.270430   21.71648   257.6  0.6615872 1.383319          ?        ? 
1 1 1   25    8   14 o 9.997704 4.113051   12.79262   156.5  0.4510822 1.323174          ?        ? 
1 1 1   25    8   15 o 26.65623 2.820367   41.49968   270.7   7.397748 1.503607          ?        ? 
1 1 1   25    8   16 o 9.758120 4.146263   9.770351    42.4  0.3007214 1.413391          ?        ? 
1 1 1   25    8   17 o 13.94071 4.477573   21.02140   162.9   2.315555 1.413391          ?        ? 
1 1 1   25    8   18 o 15.41896 3.974155   25.61251   227.0   2.916998 1.232958          ?        ? 
1 1 1   25    9    0 o 51.53566 1.755023   91.95088     0.0   26.67399 1.804329   26.67399 1.804329 
1 1 1   25    9    1 o 143.6899 1.381281   202.5039   221.3   206.6859 3.969523          ?        ? 
1 1 1   25    9    2 o 75.06260 1.141788   122.4472   356.3   56.38527 1.714112          ?        ? 
1 1 1   25    9    3 o 59.11451 1.170033   64.62195   188.2   34.97390 1.383319          ?        ? 
1 1 1   25    9    4 o 57.01930 1.107546   76.07262   293.3   32.53806 1.263030          ?        ? 
1 1 1   25    9    5 o 37.57073 1.400725   37.17196    83.3   14.13391 1.052525          ?        ? 
1 1 1   25    9    6 o 10.01907 3.671417   22.26179    99.8  0.8119479 0.9623086          ?        ? 
1 1 1   25    9    7 o 94.37099 0.9878423   134.4117   126.6   89.13383 1.864473          ?        ? 
1 1 1   25    9    8 o 44.83296 1.576285   34.45327   160.0   20.14834 1.413391          ?        ? 
1 1 1   25    9    9 o 36.43532 1.691982   44.53635   235.4   13.32196 1.232958          ?        ? 
1 1 1   25    9   10 o 19.16970 3.137467   11.41700    19.8   3.728946 1.202886          ?        ? 
1 1 1   25    9   11 o 22.80554 2.439472   34.24989   342.7   5.262625 1.112669          ?        ? 
1 1 1   25    9   12 o 21.73142 2.283285   38.18491   183.0   4.781471 0.9923807          ?        ? 
1 1 1   25    9   13 o 9.181076 4.004406   27.99154   277.9 -0.1503607 1.383319          ?        ? 
1 1 1   25    9   14 o 28.00189 2.523742   37.78120   334.3   8.029263 1.413391          ?        ? 
1 1 1   25    9   15 o 9.513510 4.050140   6.800890   137.5  0.2105050 1.353247          ?        ? 
1 1 1   25    9   16 o 15.13366 4.404788   21.73980   345.8   2.646349 1.413391          ?        ? 
1 1 1   25    9   17 o 14.53461 4.272027   22.39099   179.8   2.526060 1.323174          ?        ? 
1 1 1   25    9   18 o 11.15183 4.366001   9.418684    80.9   1.323174 1.413391          ?        ? 
1 1 1   25   10    0 o 5.481364 3.805008   1.040558   180.0 -0.9322364 1.353247 -0.9322364 1.353247 
1 1 1   25   10    1 o 28.47134 1.689960   30.22466   139.4   8.119479 0.9623086          ?        ? 
1 1 1   25   10    2 o 32.46760 1.481952   41.83051   349.0   10.55532 0.9623086          ?        ? 
1 1 1   25   10    3 o 71.28410 1.075751   87.97044   358.0   50.85200 1.533679          ?        ? 
1 1 1   25   10    4 o 43.32844 1.318697   49.15920   352.7   18.79509 1.142741          ?        ? 
1 1 1   25   10    5 o 20.11205 2.317607   46.63852   333.7   4.059740 0.9322364          ?        ? 
1 1 1   25   10    6 o 18.56456 2.105829   58.08910     4.5   3.458297 0.7818757          ?        ? 
1 1 1   25   10    7 o 38.16734 1.142459   54.70288    91.6   14.58499 0.8720922          ?        ? 
1 1 1   25   10    8 o 47.24765 1.495726   40.59021   104.6   22.37368 1.413391          ?        ? 
1 1 1   25   10    9 o 21.21703 2.692981   24.36032   208.2   4.540894 1.142741          ?        ? 
1 1 1   25   10   10 o 50.93018 1.358054   74.08906   266.3   26.01241 1.383319          ?        ? 
1 1 1   25   10   11 o 14.05346 3.847529   20.67164    99.3   2.105050 1.112669          ?        ? 
1 1 1   25   10   12 o 7.786998 3.419099   3.929246    85.7 -0.2105050 1.022453          ?        ? 
1 1 1   25   10   13 o 18.75191 3.970415   27.85064    29.9   3.819162 1.443463          ?        ? 
1 1 1   25   10   14 o 10.47705 4.241560   14.26826    95.9  0.6315150 1.383319          ?        ? 
1 1 1   25   10   15 o 33.83973 2.221660   41.54832   137.3   11.75821 1.503607          ?        ? 
1 1 1   25   10   16 o 7.773503 3.646911   15.06481   306.0  -1.202886 1.443463          ?        ? 
1 1 1   25   10   17 o 19.71037 3.797186   24.86767   328.9   4.480750 1.443463          ?        ? 
1 1 1   25   10   18 o 21.57091 3.345855   19.20876   256.6   5.292697 1.443463          ?        ? 
1 1 1   25   11    0 o 33.47425 1.991043   46.57998   180.0   11.33720 1.323174   11.33720 1.323174 
1 1 1   25   11    1 o 57.04352 1.186153   82.38300    36.8   32.56813 1.353247          ?        ? 
1 1 1   25   11    2 o 27.88306 1.671690   11.89739   114.6   7.788685 0.9322364          ?        ? 
1 1 1   25   11    3 o 66.37121 1.087417   84.34367     5.8   44.08577 1.443463          ?        ? 
1 1 1   25   11    4 o 18.96318 2.299436   20.71499    13.1   3.608657 0.8720922          ?        ? 
1 1 1   25   11    5 o 50.68209 1.157030   60.38026   305.6   25.71168 1.172814          ?        ? 
1 1 1   25   11    6 o 51.15635 1.028734   56.38161    46.1   26.19284 1.052525          ?        ? 
1 1 1   25   11    7 o 60.91613 0.9379631   89.55785    29.0   37.13910 1.142741          ?        ? 
1 1 1   25   11    8 o 9.060125 3.809672   20.46186    12.0  0.1202886 1.172814          ?        ? 
1 1 1   25   11    9 o 20.84125 2.957974   31.50482   110.9   4.390533 1.232958          ?        ? 
1 1 1   25   11   10 o 10.83440 4.039431   5.266726   242.9  0.9322364 1.172814          ?        ? 
1 1 1   25   11   11 o 26.03822 2.252101   27.86312    81.4   6.856449 1.172814          ?        ? 
1 1 1   25   11   12 o 25.76045 2.334753   31.96919    52.8   6.736160 1.202886          ?        ? 
1 1 1   25   11   13 o 18.15889 4.075108   18.38015   137.6   3.608657 1.443463          ?        ? 
1 1 1   25   11   14 o 30.56767 2.262715   40.49913    63.0   9.562942 1.383319          ?        ? 
1 1 1   25   11   15 o 9.344212 4.039076   9.050259    46.3       0.09 1.383319          ?        ? 
1 1 1   25   11   16 o 14.39032 4.566807   18.98785   290.5   2.405771 1.473535          ?        ? 
1 1 1   25   11   17 o 17.71795 4.284088   17.43167   263.9   3.789090 1.503607          ?        ? 
1 1 1   25   11   18 o 18.71478 4.200989   27.02922   142.3   4.390533 1.533679          ?        ? 
1 1 1   25   12    0 o 7.634384 4.587521   29.39841     0.0  0.6315150 1.232958  0.6315150 1.232958 
1 1 1   25   12    1 o 37.00631 1.422089   64.36535   278.3   13.71290 1.052525          ?        ? 
1 1 1   25   12    2 f 36.01931 1.419312   43.51118     8.1   12.99117 1.022453          ?        ? 
1 1 1   25   12    3 o 38.63614 1.362099   52.37635   181.4   14.94586 1.052525          ?        ? 
1 1 1   25   12    4 o 36.63249 1.559738   63.67747    13.3   13.44225 1.142741          ?        ? 
1 1 1   25   12    5 o 72.66084 0.9932882   106.6612   350.5   52.83676 1.443463          ?        ? 
1 1 1   25   12    6 o 65.17980 0.9919502   84.37984     7.8   42.52201 1.293102          ?        ? 
1 1 1   25   12    7 o 19.35261 1.942383   28.23293    53.7   3.759018 0.7518036          ?        ? 
1 1 1   25   12    8 o 21.88561 1.923684   32.23948   356.4   4.811543 0.8420200          ?        ? 
1 1 1   25   12    9 o 36.37614 1.777404   54.87754   104.3   13.29189 1.293102          ?        ? 
1 1 1   25   12   10 o 29.56592 2.135956   18.06437    97.6   8.811138 1.263030          ?        ? 
1 1 1   25   12   11 o 5.235166 2.616270   15.11546   224.5  -3.097431 1.142741          ?        ? 
1 1 1   25   12   12 o 34.30642 1.796978   52.94530   199.8   11.87850 1.232958          ?        ? 
1 1 1   25   12   13 o 21.32759 2.608522   24.64054   270.4   4.661182 1.112669          ?        ? 
1 1 1   25   12   14 o 41.07520 1.976735   59.19341   280.7   17.20127 1.623896          ?        ? 
1 1 1   25   12   15 o 27.61924 2.667588   28.97194    44.2   7.969118 1.473535          ?        ? 
1 1 1   25   12   16 o 10.65417 4.354595   17.89304   165.6  0.7818757 1.473535          ?        ? 
1 1 1   25   12   17 o 16.15332 4.493165   31.68469    89.7   3.247792 1.503607          ?        ? 
1 1 1   25   12   18 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   25   13    0 o 14.17253 5.109295   39.45861     0.0   2.676421 1.323174   2.676421 1.323174 
1 1 1   25   13    1 o 23.55226 2.106764   34.34531   338.1   5.563347 0.9923807          ?        ? 
1 1 1   25   13    2 o 54.39961 1.188522   80.88783    99.6   29.62106 1.293102          ?        ? 
1 1 1   25   13    3 o 38.94355 1.389957   18.83222   330.7   15.18643 1.082597          ?        ? 
1 1 1   25   13    4 o 71.69612 1.132485   86.88183   154.8   51.45344 1.623896          ?        ? 
1 1 1   25   13    5 o 19.27395 2.106335   23.66439   249.2   3.728946 0.8119479          ?        ? 
1 1 1   25   13    6 o 41.80882 1.150844   52.48524   116.9   17.50199 0.9623086          ?        ? 
1 1 1   25   13    7 f 82.08607 0.9891422   120.6814   248.4   67.45182 1.623896          ?        ? 
1 1 1   25   13    8 o 65.65998 0.8930964   79.26723   322.7   43.15353 1.172814          ?        ? 
1 1 1   25   13    9 o 33.48536 1.930847   54.21069   232.2   11.27705 1.293102          ?        ? 
1 1 1   25   13   10 o 27.87265 2.211771   59.33192   263.4   7.848830 1.232958          ?        ? 
1 1 1   25   13   11 o 10.68521 4.028225   34.29408    69.1  0.9021643 1.172814          ?        ? 
1 1 1   25   13   12 o 27.36938 1.977753   45.98159   180.6   7.578181 1.082597          ?        ? 
1 1 1   25   13   13 o 45.28244 1.560639   68.92567   184.6   20.68964 1.413391          ?        ? 
1 1 1   25   13   14 o 14.31035 4.517774   28.66679     3.7   2.285483 1.443463          ?        ? 
1 1 1   25   13   15 o 31.23061 2.407266   51.09446    27.8   10.10424 1.503607          ?        ? 
1 1 1   25   13   16 o 30.14412 2.543911   36.93259    66.5   9.562942 1.533679          ?        ? 
1 1 1   25   13   17 o 19.03240 4.068883   28.81958    98.6   4.390533 1.503607          ?        ? 
1 1 1   25   14    0 o 37.60041 2.256248   40.29008    -0.0   14.31434 1.684040   14.31434 1.684040 
1 1 1   25   14    1 o 109.7653 1.273950   159.0286   323.4   120.6194 2.796710          ?        ? 
1 1 1   25   14    2 o 131.3856 1.373308   185.3959   278.4   172.8547 3.608657          ?        ? 
1 1 1   25   14    3 o 10.10274 3.674405   6.969932    81.6  0.8420200 0.9623086          ?        ? 
1 1 1   25   14    4 o 34.82963 1.338281   54.12529    30.0   12.14915 0.9322364          ?        ? 
1 1 1   25   14    5 o 27.05281 1.667413   24.33552   144.0   7.337603 0.9021643          ?        ? 
1 1 1   25   14    6 o 88.54708 1.035834   100.3118   204.0   78.48830 1.834401          ?        ? 
1 1 1   25   14    7 o 40.07962 1.125465   47.02567   221.7   16.08860 0.9021643          ?        ? 
1 1 1   25   14    8 o 40.12107 1.011872   61.34539    97.3   16.11867 0.8119479          ?        ? 
1 1 1   25   14    9 o 54.94340 1.423057   82.54510    86.9   30.28265 1.563751          ?        ? 
1 1 1   25   14   10 o 30.57727 2.114483   41.06311   330.1   9.442654 1.293102          ?        ? 
1 1 1   25   14   11 o 32.73291 1.975233   49.87994    93.8   10.82597 1.293102          ?        ? 
1 1 1   25   14   12 o 43.38416 1.594267   56.49362    92.0   18.97552 1.383319          ?        ? 
1 1 1   25   14   13 o 49.43253 1.520868   63.94983   319.1   24.65916 1.503607          ?        ? 
1 1 1   25   14   14 o 9.583928 4.111426   5.223115   284.5  0.1503607 1.413391          ?        ? 
1 1 1   25   14   15 o 21.03407 3.431250   27.31474   263.2   4.751399 1.443463          ?        ? 
1 1 1   25   14   16 o 19.06043 3.993722   28.76765   102.6   4.240172 1.473535          ?        ? 
1 1 1   25   14   17 f 12.47300 4.503766   18.44374   156.3   1.894545 1.443463          ?        ? 
1 1 1   25   15    0 o 103.8502 1.811058   133.6792   180.0   108.0793 3.759018   108.0793 3.759018 
1 1 1   25   15    1 o 105.2617 1.271317   113.2516   219.5   110.9361 2.676421          ?        ? 
1 1 1   25   15    2 o 29.59168 1.880037   45.74450    14.4   8.781067 1.112669          ?        ? 
1 1 1   25   15    3 o 42.08577 1.429089   45.60527   229.9   17.74257 1.202886          ?        ? 
1 1 1   25   15    4 o 64.92363 1.019024   88.67260   249.7   42.19122 1.323174          ?        ? 
1 1 1   25   15    5 o 56.26816 1.068887   66.67209   230.4   31.69604 1.202886          ?        ? 
1 1 1   25   15    6 o 38.23305 1.297805   65.12268   271.1   14.64513 0.9923807          ?        ? 
1 1 1   25   15    7 o 37.92330 1.149810   63.65540    46.4   14.40456 0.8720922          ?        ? 
1 1 1   25   15    8 o 22.36897 1.546024   23.24845   172.3   5.022048 0.6916593          ?        ? 
1 1 1   25   15    9 o 46.91339 1.506383   68.69654   184.4   22.10303 1.413391          ?        ? 
1 1 1   25   15   10 f 39.29791 1.721779   37.32515   146.2   15.54730 1.353247          ?        ? 
1 1 1   25   15   11 o 16.16224 3.861535   21.79487    53.3   2.826782 1.232958          ?        ? 
1 1 1   25   15   12 o 35.63703 1.772075   39.84806   245.5   12.84081 1.263030          ?        ? 
1 1 1   25   15   13 o 21.31959 2.891608   36.85212     5.3   4.721327 1.232958          ?        ? 
1 1 1   25   15   14 o 10.74469 4.313148   27.10363    89.8  0.8119479 1.413391          ?        ? 
1 1 1   25   15   15 o 20.54101 3.220811   25.04400    96.7   4.510822 1.323174          ?        ? 
1 1 1   25   15   16 o 18.55733 4.362922   25.72117    36.4   4.149956 1.593824          ?        ? 
1 1 1   25   15   17 o 12.99267 4.606005   14.58873   158.4   2.135122 1.503607          ?        ? 
1 1 1   25   16    0 o 130.8927 2.091889   163.4296   180.0   171.7721 5.473131   171.7721 5.473131 
1 1 1   25   16    1 o 16.64967 3.184181   8.223112   134.8   2.886926 1.022453          ?        ? 
1 1 1   25   16    2 o 31.27161 1.682877   42.05841    13.0   9.803518 1.052525          ?        ? 
1 1 1   25   16    3 o 61.15460 1.081827   81.11547   117.1   37.43982 1.323174          ?        ? 
1 1 1   25   16    4 o 34.78033 1.383409   43.38432   172.2   12.11907 0.9623086          ?        ? 
1 1 1   25   16    5 o 11.16670 3.435944   19.35715   132.2   1.263030 0.8420200          ?        ? 
1 1 1   25   16    6 o 19.25011 2.265162   21.92859   340.1   3.728946 0.8720922          ?        ? 
1 1 1   25   16    7 o 11.00387 3.371630   14.57342   138.6   1.232958 0.8119479          ?        ? 
1 1 1   25   16    8 o 41.32515 1.127929   46.28714    50.2   17.11105 0.9322364          ?        ? 
1 1 1   25   16    9 o 36.44947 1.113799   56.19674    10.9   13.32196 0.8119479          ?        ? 
1 1 1   25   16   10 o 10.40740 4.077143   10.49772    21.8  0.7217315 1.232958          ?        ? 
1 1 1   25   16   11 o 18.47438 3.464816   14.63011   308.2   3.638730 1.232958          ?        ? 
1 1 1   25   16   12 o 13.84535 4.137447   12.67167   179.6   2.074978 1.232958          ?        ? 
1 1 1   25   16   13 o 45.66853 1.547445   53.12349   253.9   21.11065 1.413391          ?        ? 
1 1 1   25   16   14 o 9.861923 4.213235   16.00911   121.2  0.2706493 1.473535          ?        ? 
1 1 1   25   16   15 o 6.602125 3.193499   7.039096   277.5  -1.834401 1.293102          ?        ? 
1 1 1   25   16   16 o 7.674957 3.611563   5.788313    29.5  -1.142741 1.443463          ?        ? 
1 1 1   25   16   17 o 25.95387 3.128427   31.79315    95.4   7.578181 1.623896          ?        ? 
1 1 1   25   17    0 f 6.568367 4.338277   14.21662     0.0 -0.1804329 1.413391 -0.1804329 1.413391 
1 1 1   25   17    1 f 31.41039 1.723311   44.36269   115.7   9.893736 1.082597          ?        ? 
1 1 1   25   17    2 o 34.11013 1.719158   30.02415   143.8   11.66799 1.172814          ?        ? 
1 1 1   25   17    3 o 61.20412 1.056385   83.38714     3.7   37.49996 1.293102          ?        ? 
1 1 1   25   17    4 o 29.44171 1.583190   33.66376    74.6   8.690849 0.9322364          ?        ? 
1 1 1   25   17    5 o 63.64238 1.134042   98.72999    92.0   40.56732 1.443463          ?        ? 
1 1 1   25   17    6 o 38.81495 1.278349   53.12911   125.1   15.09622 0.9923807          ?        ? 
1 1 1   25   17    7 o 17.18607 2.274738   17.94064   228.9   2.977142 0.7818757          ?        ? 
1 1 1   25   17    8 o 11.81303 3.038157   11.56276    43.3   1.473535 0.7217315          ?        ? 
1 1 1   25   17    9 o 33.04444 1.046559   50.65905   103.8   10.94626 0.6916593          ?        ? 
1 1 1   25   17   10 o 27.75323 2.329643   41.85105    56.1   7.818758 1.293102          ?        ? 
1 1 1   25   17   11 f 30.60337 2.112680   42.00862   164.4   9.502798 1.293102          ?        ? 
1 1 1   25   17   12 o 47.91086 1.600555   57.05743   163.3   23.18562 1.533679          ?        ? 
1 1 1   25   17   13 o 24.75421 2.611884   27.24816   336.1   6.345222 1.293102          ?        ? 
1 1 1   25   17   14 o 10.71801 4.068061   19.34483    40.3   1.022453 1.202886          ?        ? 
1 1 1   25   17   15 o 41.29516 1.966206   47.51071   235.8   17.59221 1.623896          ?        ? 
1 1 1   25   17   16 o 22.41892 3.621708   29.60836   113.4   5.743780 1.623896          ?        ? 
1 1 1   25   18    0 o 32.42591 2.343044   4.455387     0.0   10.70568 1.503607   10.70568 1.503607 
1 1 1   25   18    1 o 40.06442 1.538719   33.51605   321.4   16.08860 1.232958          ?        ? 
1 1 1   25   18    2 o 67.90340 1.062880   95.48370   186.0   46.16074 1.443463          ?        ? 
1 1 1   25   18    3 o 8.536328 3.509021   16.00938    34.2  0.2405772 0.9623086          ?        ? 
1 1 1   25   18    4 o 14.63783 3.267926   1.628674    78.5   2.255411 0.9322364          ?        ? 
1 1 1   25   18    5 o 13.62041 3.423409   9.965198   158.3   1.954689 0.9322364          ?        ? 
1 1 1   25   18    6 o 22.20633 2.031322   33.54232   113.9   4.961904 0.9021643          ?        ? 
1 1 1   25   18    7 o 12.41795 3.323681   28.74786   261.9   1.623896 0.8420200          ?        ? 
1 1 1   25   18    8 o 7.812371 3.141686   9.171114   276.1  0.3007214 0.7518036          ?        ? 
1 1 1   25   18    9 o 38.95286 1.080819   43.97450   238.1   15.21651 0.8420200          ?        ? 
1 1 1   25   18   10 f 10.00443 4.113969   26.25938    28.2  0.4210100 1.323174          ?        ? 
1 1 1   25   18   11 o 24.87232 2.659933   38.40655    57.9   6.345222 1.323174          ?        ? 
1 1 1   25   18   12 o 28.77899 2.246608   35.22647   243.8   8.480345 1.293102          ?        ? 
1 1 1   25   18   13 o 17.34516 3.830077   12.23082    46.2   3.368080 1.293102          ?        ? 
1 1 1   25   18   14 o 10.66280 4.175768   10.90095   284.5  0.9322364 1.293102          ?        ? 
1 1 1   25   18   15 o 8.628990 3.930873   6.323164   351.1 -0.5112265 1.503607          ?        ? 
1 1 1   25   18   16 o 25.48682 3.185756   30.57303   287.1   7.277459 1.623896          ?        ? 
1 1 1   25   19    0 o 16.65769 5.580141   25.44646   180.0   3.608657 1.653968   3.608657 1.653968 
1 1 1   25   19    1 o 71.83088 1.067563   92.22129   354.0   51.66394 1.533679          ?        ? 
1 1 1   25   19    2 o 21.16870 2.343982   12.53167   111.4   4.510822 0.9923807          ?        ? 
1 1 1   25   19    3 o 15.33593 3.147581   30.05901   206.2   2.465916 0.9322364          ?        ? 
1 1 1   25   19    4 o 68.88644 1.025885   74.32357     9.5   47.51399 1.413391          ?        ? 
1 1 1   25   19    5 o 53.47613 1.209046   63.54078     2.5   28.65875 1.293102          ?        ? 
1 1 1   25   19    6 f 50.62494 1.158336   59.39368    58.6   25.68161 1.172814          ?        ? 
1 1 1   25   19    7 f 10.08994 3.459287   15.76923   191.7  0.9623086 0.8420200          ?        ? 
1 1 1   25   19    8 o 6.183088 2.821473   10.49876   193.2 -0.5112265 0.7818757          ?        ? 
1 1 1   25   19    9 o 13.58040 2.858000   14.09648    92.2   1.954689 0.7518036          ?        ? 
1 1 1   25   19   10 o 21.23430 1.487016   21.64678     1.5   4.540894 0.6315150          ?        ? 
1 1 1   25   19   11 o 40.91934 1.580063   60.75217    32.8   16.90055 1.293102          ?        ? 
1 1 1   25   19   12 o 29.59019 2.286648   38.04162   348.7   8.991571 1.353247          ?        ? 
1 1 1   25   19   13 o 7.659548 3.532244   18.52570    27.5 -0.7818757 1.263030          ?        ? 
1 1 1   25   19   14 o 14.84633 4.114270   16.06084   194.9   2.556132 1.263030          ?        ? 
1 1 1   25   19   15 o 13.06118 4.690482   23.71175    46.2   1.984761 1.563751          ?        ? 
1 1 1   25   19   16 o 15.48491 4.433479   15.11817   249.0   3.097431 1.443463          ?        ? 
1 1 1   25   20    0 o 58.50510 1.854529   67.37779   180.0   34.40253 2.165194   34.40253 2.165194 
1 1 1   25   20    1 o 31.87342 1.698276   55.49215   261.7   10.19446 1.082597          ?        ? 
1 1 1   25   20    2 o 55.31129 1.168932   59.18900    92.6   30.64352 1.293102          ?        ? 
1 1 1   25   20    3 o 35.06271 1.500918   50.90452   303.9   12.32958 1.052525          ?        ? 
1 1 1   25   20    4 o 42.34830 1.349218   60.60158   300.9   17.98314 1.142741          ?        ? 
1 1 1   25   20    5 o 28.84855 1.719984   39.79996    74.6   8.360056 0.9923807          ?        ? 
1 1 1   25   20    6 o 73.67490 1.061251   89.68974   224.2   54.40051 1.563751          ?        ? 
1 1 1   25   20    7 o 40.78195 1.253561   31.19432   109.9   16.69004 1.022453          ?        ? 
1 1 1   25   20    8 o 34.24775 1.404922   38.53667    72.6   11.78828 0.9623086          ?        ? 
1 1 1   25   20    9 o 14.23071 2.739226   11.56845   303.7   2.135122 0.7518036          ?        ? 
1 1 1   25   20   10 o 18.72256 1.847129   30.56990   248.8   3.548513 0.6916593          ?        ? 
1 1 1   25   20   11 o 13.95128 4.310116   16.75821    44.3   2.135122 1.323174          ?        ? 
1 1 1   25   20   12 o 23.08730 2.670208   23.31146     8.6   5.533275 1.232958          ?        ? 
1 1 1   25   20   13 o 36.03336 2.044682   49.58664    71.1   13.32196 1.473535          ?        ? 
1 1 1   25   20   14 o 27.06415 2.388958   34.12257   139.7   7.668397 1.293102          ?        ? 
1 1 1   25   20   15 o 12.85953 4.642470   14.63554    74.3   1.984761 1.533679          ?        ? 
1 1 1   25   20   16 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   25   21    0 o 5.208102 3.605975   16.00566   180.0 -0.7818757 1.202886 -0.7818757 1.202886 
1 1 1   25   21    1 o 17.33565 2.775519   20.03745   153.1   3.037287 0.9623086          ?        ? 
1 1 1   25   21    2 o 8.175539 3.501720   24.51049   174.5      -0.03 1.022453          ?        ? 
1 1 1   25   21    3 o 88.28948 1.106978   121.0547   216.1   78.09737 1.954689          ?        ? 
1 1 1   25   21    4 o 19.75156 2.512158   29.92284   188.4   3.939451 0.9923807          ?        ? 
1 1 1   25   21    5 o 35.07878 1.500230   33.72491   213.4   12.35965 1.052525          ?        ? 
1 1 1   25   21    6 o 18.79704 2.399751   23.86422   250.7   3.578585 0.9021643          ?        ? 
1 1 1   25   21    7 o 25.91119 1.798907   22.58365   271.1   6.766232 0.9322364          ?        ? 
1 1 1   25   21    8 o 22.07640 2.043278   29.66251   147.9   4.931832 0.9021643          ?        ? 
1 1 1   25   21    9 o 20.59594 2.044141   20.74916   233.1   4.300317 0.8420200          ?        ? 
1 1 1   25   21   10 o 29.31596 1.436112   28.33686   252.7   8.660777 0.8420200          ?        ? 
1 1 1   25   21   11 o 31.73809 1.089636   39.04131   273.8   10.13431 0.6916593          ?        ? 
1 1 1   25   21   12 o 11.22303 4.264605   13.86648   282.7   1.142741 1.323174          ?        ? 
1 1 1   25   21   13 o 10.66880 4.062591   12.39880     7.8   1.022453 1.202886          ?        ? 
1 1 1   25   21   14 o 14.24000 4.104160   20.93098   276.2   2.405771 1.232958          ?        ? 
1 1 1   25   21   15 o 15.45633 4.667776   23.23253   320.4   3.127503 1.563751          ?        ? 
1 1 1   25   22    0 f 50.00066 1.688237   44.19676    -0.0   25.14031 1.684040   25.14031 1.684040 
1 1 1   25   22    1 o 51.80465 1.073909   43.23006    48.2   26.88450 1.112669          ?        ? 
1 1 1   25   22    2 o 23.55995 2.233717   41.29305   260.0   5.593419 1.052525          ?        ? 
1 1 1   25   22    3 o 25.16599 1.971671   28.89014    40.4   6.375295 0.9923807          ?        ? 
1 1 1   25   22    4 o 28.01993 1.878172   41.56365   280.7   7.908974 1.052525          ?        ? 
1 1 1   25   22    5 o 19.10624 2.439613   14.86263    34.1   3.698874 0.9322364          ?        ? 
1 1 1   25   22    6 o 20.68587 2.253318   33.16738   149.0   4.330389 0.9322364          ?        ? 
1 1 1   25   22    7 o 24.71401 1.825208   38.89740   320.1   6.164790 0.9021643          ?        ? 
1 1 1   25   22    8 o 27.89598 1.670916   28.66150   214.6   7.848830 0.9322364          ?        ? 
1 1 1   25   22    9 o 27.60216 1.688702   37.40678   180.8   7.698469 0.9322364          ?        ? 
1 1 1   25   22   10 o 20.83011 2.021161   35.66569   269.6   4.420605 0.8420200          ?        ? 
1 1 1   25   22   11 o 36.21354 1.121056   58.02710   239.8   13.20167 0.8119479          ?        ? 
1 1 1   25   22   12 o 9.846089 4.087660   6.881782   208.5  0.4811543 1.323174          ?        ? 
1 1 1   25   22   13 o 9.082918 3.938525   18.73523   224.8  0.1202886 1.323174          ?        ? 
1 1 1   25   22   14 o 8.020066 3.651300   4.732576   317.6 -0.4510822 1.293102          ?        ? 
1 1 1   25   22   15 o 13.67923 4.792919   7.566315   105.7   2.465916 1.623896          ?        ? 
1 1 1   25   23    0 o 6.026123 3.949350   10.87829     0.0      -0.06 1.142741      -0.06 1.142741 
1 1 1   25   23    1 o 50.79604 1.095232   52.31381   272.5   25.86205 1.112669          ?        ? 
1 1 1   25   23    2 o 56.55547 1.036870   67.25935   322.5   32.05691 1.172814          ?        ? 
1 1 1   25   23    3 o 44.99876 1.336577   60.82478    26.7   20.32877 1.202886          ?        ? 
1 1 1   25   23    4 o 11.21756 3.755612   11.73397    79.6   1.232958 0.9923807          ?        ? 
1 1 1   25   23    5 o 23.84316 2.081060   28.38138   338.4   5.743780 0.9923807          ?        ? 
1 1 1   25   23    6 o 24.94952 1.868245   24.97978   312.6   6.285078 0.9322364          ?        ? 
1 1 1   25   23    7 f 18.24511 2.637168   23.01708   315.0   3.398152 0.9623086          ?        ? 
1 1 1   25   23    8 o 5.430949 2.636662   9.131185   299.2  -1.503607 0.9021643          ?        ? 
1 1 1   25   23    9 o 17.12190 2.546715   18.70473   216.2   3.007215 0.8720922          ?        ? 
1 1 1   25   23   10 o 9.000308 3.407249   17.25352   319.8  0.6615872 0.8420200          ?        ? 
1 1 1   25   23   11 o 6.337026 2.870831   15.67578   286.9 -0.3608657 0.7818757          ?        ? 
1 1 1   25   23   12 o 10.25578 2.931242   12.70511   275.8   1.142741 0.6315150          ?        ? 
1 1 1   25   23   13 o 12.02579 4.402352   15.44879    78.0   1.563751 1.383319          ?        ? 
1 1 1   25   23   14 o 9.122364 3.899097   8.127022   119.3  0.3909379 1.263030          ?        ? 
1 1 1   25   24    0 o 6.092309 4.063910   19.41112   180.0 -0.2706493 1.293102 -0.2706493 1.293102 
1 1 1   25   24    1 o 17.30583 2.519648   15.80158   205.2   3.037287 0.8720922          ?        ? 
1 1 1   25   24    2 o 40.18738 1.272107   56.63245   129.6   16.20889 1.022453          ?        ? 
1 1 1   25   24    3 o 33.64101 1.385566   47.01708   142.1   11.36727 0.9322364          ?        ? 
1 1 1   25   24    4 o 43.73262 1.375273   72.82956   166.1   19.21610 1.202886          ?        ? 
1 1 1   25   24    5 o 37.99728 1.464143   50.21040   234.9   14.52485 1.112669          ?        ? 
1 1 1   25   24    6 f 37.29028 1.370938   46.47964    40.9   13.98355 1.022453          ?        ? 
1 1 1   25   24    7 o 32.75703 1.606564   30.54085   191.8   10.82597 1.052525          ?        ? 
1 1 1   25   24    8 o 17.91644 2.853394   25.49614   330.3   3.307936 1.022453          ?        ? 
1 1 1   25   24    9 o 17.15398 2.541953   20.70458   303.5   3.037287 0.8720922          ?        ? 
1 1 1   25   24   10 o 7.662633 3.225305   14.26335   183.6  0.1503607 0.8420200          ?        ? 
1 1 1   25   24   11 o 9.819095 3.505121   2.296456   137.6  0.9322364 0.8720922          ?        ? 
1 1 1   25   24   12 o 26.98221 1.448872   33.42557   316.0   7.397748 0.7818757          ?        ? 
1 1 1   25   24   13 o 17.02645 3.723165   20.96321   299.4   3.368080 1.232958          ?        ? 
1 1 1   25   24   14 o 18.37116 3.810798   23.00222   289.6   4.059740 1.353247          ?        ? 
1 1 1   25   25    0 o 8.054616 4.699300   25.08223    -0.0  0.8420200 1.232958  0.8420200 1.232958 
1 1 1   25   25    1 o 36.17340 1.330133   33.93467   150.3   13.14153 0.9623086          ?        ? 
1 1 1   25   25    2 o 18.60953 2.504729   30.87108   264.7   3.518441 0.9322364          ?        ? 
1 1 1   25   25    3 o 9.811114 3.782642   16.75003    43.2  0.6916593 1.052525          ?        ? 
1 1 1   25   25    4 o 19.96189 2.561012   50.69090   172.8   4.059740 1.022453          ?        ? 
1 1 1   25   25    5 o 33.80343 1.868198   40.21812   278.5   11.54770 1.263030          ?        ? 
1 1 1   25   25    6 o 35.22599 1.750068   39.88376   151.1   12.54008 1.232958          ?        ? 
1 1 1   25   25    7 o 36.20332 1.785889   52.78622    12.2   13.26182 1.293102          ?        ? 
1 1 1   25   25    8 o 8.956592 3.763061   3.521349   324.5  0.2405772 1.142741          ?        ? 
1 1 1   25   25    9 f 24.97381 2.468502   16.59403   146.3   6.435439 1.232958          ?        ? 
1 1 1   25   25   10 o 18.82340 3.115308   20.53654   181.9   3.759018 1.172814          ?        ? 
1 1 1   25   25   11 o 33.37632 1.486654   37.93390   167.0   11.30713 0.9923807          ?        ? 
1 1 1   25   25   12 o 9.439794 3.436718   22.56849   221.8  0.8720922 0.8420200          ?        ? 
1 1 1   25   25   13 o 13.70366 2.617309   21.07727   249.1   2.074978 0.6916593          ?        ? 
1 1 1   25   25   14 o 29.12927 2.477685   36.60743    92.7   9.172004 1.443463          ?        ? 
1 1 1   25   26    0 o 37.67929 1.885592   45.75977   180.0   14.37449 1.413391   14.37449 1.413391 
1 1 1   25   26    1 o 22.16541 2.374252   31.94316    64.9   4.991976 1.052525          ?        ? 
1 1 1   25   26    2 f 26.24384 2.119868   57.65453   234.3   6.976738 1.112669          ?        ? 
1 1 1   25   26    3 o 12.19702 3.918847   14.76218   358.0   1.533679 1.082597          ?        ? 
1 1 1   25   26    4 o 32.37493 1.764856   50.83130   173.6   10.58539 1.142741          ?        ? 
1 1 1   25   26    5 o 8.358440 3.565552   7.400846    56.0       0.06 1.052525          ?        ? 
1 1 1   25   26    6 o 32.87101 1.875448   24.49790   309.8   10.94626 1.232958          ?        ? 
1 1 1   25   26    7 o 16.81790 3.592144   28.93149   173.7   3.097431 1.172814          ?        ? 
1 1 1   25   26    8 o 14.03162 4.123702   21.05639   347.6   2.195267 1.232958          ?        ? 
1 1 1   25   26    9 o 22.53922 2.601717   26.03654    81.2   5.292697 1.172814          ?        ? 
1 1 1   25   26   10 o 12.81456 3.951106   12.29747   153.1   1.834401 1.112669          ?        ? 
1 1 1   25   26   11 o 19.94816 3.165781   22.29210   106.1   4.300317 1.263030          ?        ? 
1 1 1   25   26   12 o 16.97848 3.396712   21.41129   286.4   3.277864 1.112669          ?        ? 
1 1 1   25   26   13 f 27.73759 1.517832   29.99451   342.6   7.908974 0.8420200          ?        ? 
1 1 1   25   27    0 o 53.12769 2.158655   67.86935    -0.0   28.56854 2.285483   28.56854 2.285483 
1 1 1   25   27    1 o 31.52177 2.098826   40.92567    87.7   10.07417 1.323174          ?        ? 
1 1 1   25   27    2 f 60.12461 1.225401   69.91656    47.3   36.32715 1.473535          ?        ? 
1 1 1   25   27    3 o 33.41169 1.710093   39.07144    39.8   11.27705 1.142741          ?        ? 
1 1 1   25   27    4 o 7.422587 3.326281   7.490526   133.4 -0.3909379 1.022453          ?        ? 
1 1 1   25   27    5 o 8.393914 3.625309   8.487628   292.9      -0.03 1.112669          ?        ? 
1 1 1   25   27    6 o 16.67574 3.272502   28.20215   140.5   3.007215 1.052525          ?        ? 
1 1 1   25   27    7 o 24.97769 2.468118   33.15844   184.8   6.435439 1.232958          ?        ? 
1 1 1   25   27    8 o 11.84173 4.173644   11.87748   346.3   1.443463 1.232958          ?        ? 
1 1 1   25   27    9 o 41.78811 1.691140   48.20181    48.5   17.77264 1.413391          ?        ? 
1 1 1   25   27   10 o 18.84041 3.396140   23.63311    82.6   3.939451 1.232958          ?        ? 
1 1 1   25   27   11 o 14.76797 4.053276   16.02986    28.1   2.586205 1.232958          ?        ? 
1 1 1   25   27   12 o 5.915416 2.903163   2.270020   232.7  -1.984761 1.172814          ?        ? 
1 1 1   25   28    0 o 62.02899 1.943428   73.34838    -0.0   38.85321 2.405771   38.85321 2.405771 
1 1 1   25   28    1 o 13.34167 4.227432   15.52087   106.0   1.894545 1.263030          ?        ? 
1 1 1   25   28    2 o 23.28804 2.647191   31.90643   163.5   5.563347 1.232958          ?        ? 
1 1 1   25   28    3 o 26.87275 2.070256   32.67695   142.6   7.337603 1.112669          ?        ? 
1 1 1   25   28    4 o 16.44087 3.317207   13.02640    58.5   2.916998 1.052525          ?        ? 
1 1 1   25   28    5 o 10.11592 3.973260   17.52578   104.0  0.7518036 1.172814          ?        ? 
1 1 1   25   28    6 o 24.05209 2.375556   28.69538   322.5   5.954284 1.142741          ?        ? 
1 1 1   25   28    7 o 12.05348 3.976718   11.00046   310.3   1.563751 1.112669          ?        ? 
1 1 1   25   28    8 o 11.54777 4.117121   10.13873   177.1   1.353247 1.202886          ?        ? 
1 1 1   25   28    9 o 23.01971 2.678049   18.06037   326.1   5.563347 1.232958          ?        ? 
1 1 1   25   28   10 o 8.653647 3.799868   5.876895    40.4   0.000000 1.263030          ?        ? 
1 1 1   25   28   11 o 10.14912 4.075946   9.110162    27.5  0.8720922 1.263030          ?        ? 
1 1 1   25   28   12 o 6.139245 2.995309   12.95810   199.9  -1.804329 1.202886          ?        ? 
1 1 1   25   29    0 o 21.54318 4.800554   29.29052     0.0   5.443058 1.804329   5.443058 1.804329 
1 1 1   25   29    1 o 28.92987 2.390814   32.30817    39.2   8.570561 1.383319          ?        ? 
1 1 1   25   29    2 o 20.86446 3.098815   26.32546    87.9   4.540894 1.293102          ?        ? 
1 1 1   25   29    3 o 7.946475 3.602239   12.56240   346.7 -0.5412986 1.232958          ?        ? 
1 1 1   25   29    4 o 20.81833 2.816782   30.76209   292.6   4.510822 1.172814          ?        ? 
1 1 1   25   29    5 o 13.84279 4.007080   19.70310   107.8   2.135122 1.172814          ?        ? 
1 1 1   25   29    6 o 17.40898 3.230398   25.76565    48.1   3.307936 1.082597          ?        ? 
1 1 1   25   29    7 o 11.89295 3.867744   17.03838   267.4   1.533679 1.052525          ?        ? 
1 1 1   25   29    8 o 10.85522 3.998587   7.838050    29.1   1.142741 1.142741          ?        ? 
1 1 1   25   29    9 o 22.88974 2.956011   23.75587   176.2   5.623491 1.353247          ?        ? 
1 1 1   25   29   10 o 16.76672 3.996739   27.81192    49.8   3.338008 1.323174          ?        ? 
1 1 1   25   29   11 o 31.52087 2.051184   41.73064   253.4   10.43503 1.293102          ?        ? 
1 1 1   25   30    0 o 7.487934 5.025411   5.657262   180.0 -0.3909379 2.044906 -0.3909379 2.044906 
1 1 1   25   30    1 o 15.40566 4.185985   25.58950   358.2   2.676421 1.323174          ?        ? 
1 1 1   25   30    2 o 7.677241 3.537298   2.770400    53.8 -0.8119479 1.263030          ?        ? 
1 1 1   25   30    3 o 24.36207 2.715644   42.74133   168.9   6.164790 1.323174          ?        ? 
1 1 1   25   30    4 o 19.60056 3.501583   13.69211    92.3   4.210100 1.323174          ?        ? 
1 1 1   25   30    5 o 10.01330 3.960451   17.36302   108.3  0.7518036 1.172814          ?        ? 
1 1 1   25   30    6 o 31.12475 1.980671   42.93533   126.4   9.923808 1.232958          ?        ? 
1 1 1   25   30    7 o 30.49934 2.021286   31.89246   358.3   9.562942 1.232958          ?        ? 
1 1 1   25   30    8 o 33.44851 1.798116   39.22763   317.7   11.48756 1.202886          ?        ? 
1 1 1   25   30    9 o 38.94223 1.660283   39.81875   355.8   15.54730 1.293102          ?        ? 
1 1 1   25   30   10 o 11.70705 4.259234   15.18396   284.6   1.593824 1.293102          ?        ? 
1 1 1   25   30   11 o 11.11681 4.182525   16.73266   143.9   1.413391 1.263030          ?        ? 
1 1 1   25   31    0 o 14.53456 6.219610   13.46032   180.0   3.247792 1.834401   3.247792 1.834401 
1 1 1   25   31    1 o 8.167658 3.754470   23.86631   357.8 -0.8119479 1.413391          ?        ? 
1 1 1   25   31    2 o 11.02619 4.243249   15.30436   176.4   1.052525 1.323174          ?        ? 
1 1 1   25   31    3 o 9.308302 3.960835   15.01010   254.6  0.2405772 1.293102          ?        ? 
1 1 1   25   31    4 o 28.07741 2.463402   22.01256   260.4   8.179624 1.383319          ?        ? 
1 1 1   25   31    5 o 8.036029 3.656623   13.07464   118.6 -0.5713707 1.293102          ?        ? 
1 1 1   25   31    6 o 31.24183 2.021377   26.08195   260.6   10.04410 1.263030          ?        ? 
1 1 1   25   31    7 o 24.05468 2.562824   13.83620   195.5   6.104645 1.232958          ?        ? 
1 1 1   25   31    8 o 13.00601 4.002928   13.97787   100.7   1.984761 1.142741          ?        ? 
1 1 1   25   31    9 o 13.18793 4.116669   21.59891   305.3   2.135122 1.202886          ?        ? 
1 1 1   25   31   10 o 11.08846 4.054125   12.17681   348.8   1.413391 1.172814          ?        ? 
1 1 1   25   32    0 o 30.47570 3.169593   27.59113   180.0   9.863664 1.894545   9.863664 1.894545 
1 1 1   25   32    1 f 37.89058 2.063510   41.60814    94.3   14.73535 1.563751          ?        ? 
1 1 1   25   32    2 o 15.78338 4.406348   19.14571   115.2   2.886926 1.443463          ?        ? 
1 1 1   25   32    3 o 12.70491 4.236900   7.169844   265.9   1.774257 1.263030          ?        ? 
1 1 1   25   32    4 o 12.76737 4.471673   15.67183   324.0   1.774257 1.413391          ?        ? 
1 1 1   25   32    5 o 19.48389 3.608350   21.32284   329.6   4.270245 1.353247          ?        ? 
1 1 1   25   32    6 o 21.62286 3.059666   31.21070   135.4   5.052120 1.323174          ?        ? 
1 1 1   25   32    7 o 7.497611 3.418532   6.508280   288.5 -0.4811543 1.142741          ?        ? 
1 1 1   25   32    8 o 16.00724 3.885018   22.19768   144.2   3.097431 1.232958          ?        ? 
1 1 1   25   32    9 o 39.84373 1.660455   39.77109   212.1   16.41939 1.323174          ?        ? 
1 1 1   25   33    0 o 22.05528 5.523214   35.97094     0.0   6.074574 2.105050   6.074574 2.105050 
1 1 1   25   33    1 o 8.615271 3.844582   9.042213    85.7 -0.2706493 1.353247          ?        ? 
1 1 1   25   33    2 o 10.71743 4.216861   14.12536   160.4  0.9623086 1.323174          ?        ? 
1 1 1   25   33    3 o 30.01090 2.404898   27.43432   176.8   9.412581 1.443463          ?        ? 
1 1 1   25   33    4 o 28.35558 2.545290   28.62474    69.8   8.480345 1.443463          ?        ? 
1 1 1   25   33    5 o 27.56513 2.618277   31.73110     9.4   8.059335 1.443463          ?        ? 
1 1 1   25   33    6 o 38.67637 2.021585   44.49296   211.2   15.54730 1.563751          ?        ? 
1 1 1   25   33    7 o 33.17211 2.175718   32.09189   209.6   11.60785 1.443463          ?        ? 
1 1 1   25   33    8 o 21.53850 2.862218   15.67679   179.7   5.112265 1.232958          ?        ? 
1 1 1   25   34    0 o 10.48475 6.056080   10.86508    -0.0   1.834401 2.014834   1.834401 2.014834 
1 1 1   25   34    1 o 14.71635 4.254984   14.58634    87.6   2.586205 1.323174          ?        ? 
1 1 1   25   34    2 o 10.27152 4.152454   9.244860   122.7  0.8119479 1.323174          ?        ? 
1 1 1   25   34    3 o 9.025430 3.969822   3.239795    39.0       0.03 1.383319          ?        ? 
1 1 1   25   34    4 o 11.87590 4.395077   10.23581   143.6   1.533679 1.383319          ?        ? 
1 1 1   25   34    5 o 42.84776 1.894960   45.18433   107.9   19.06574 1.623896          ?        ? 
1 1 1   25   34    6 o 17.02359 4.176999   14.49163    79.3   3.608657 1.413391          ?        ? 
1 1 1   25   34    7 o 20.12388 3.799893   24.10361   286.4   4.871688 1.473535          ?        ? 
1 1 1   25   35    0 o 39.13116 2.914024   60.40371    -0.0   16.17881 2.255411   16.17881 2.255411 
1 1 1   25   35    1 o 9.962794 4.160506   5.587090    76.5  0.6315150 1.383319          ?        ? 
1 1 1   25   35    2 o 10.97866 4.314173   17.59401   116.5   1.172814 1.383319          ?        ? 
1 1 1   25   35    3 o 8.439682 3.892136   5.105816   123.0 -0.6014429 1.533679          ?        ? 
1 1 1   25   35    4 o 21.69702 3.326408   24.31407   334.1   5.322770 1.443463          ?        ? 
1 1 1   25   35    5 o 15.08874 4.581214   17.63709   249.9   2.977142 1.503607          ?        ? 
1 1 1   25   35    6 o 31.27675 2.547937   27.28220   141.2   10.61547 1.593824          ?        ? 
1 1 1   25   36    0 o 18.93646 6.338378   22.36852   360.0   5.292697 2.135122   5.292697 2.135122 
1 1 1   25   36    1 f 11.93580 4.643793   8.623693   232.8   1.623896 1.593824          ?        ? 
1 1 1   25   36    2 o 17.67719 4.220226   11.54039   353.9   3.909379 1.473535          ?        ? 
1 1 1   25   36    3 o 14.50089 4.506194   20.13019   200.9   2.736565 1.443463          ?        ? 
1 1 1   25   36    4 o 14.62180 4.660993   24.70074    30.9   2.856854 1.533679          ?        ? 
1 1 1   26    0    0 o 20.36985 5.477834   29.93063     0.0   4.961904 1.924617   4.961904 1.924617 
1 1 1   26    0    1 o 59.33418 1.319200   74.30035   180.0   35.27463 1.563751   35.27463 1.563751 
1 1 1   26    0    2 o 57.52967 1.360774   58.31351   180.0   33.16957 1.563751   33.16957 1.563751 
1 1 1   26    0    3 o 113.7534 1.480993   163.6553     0.0   129.5508 3.368080   129.5508 3.368080 
1 1 1   26    0    4 o 89.69903 1.358485   130.4111     0.0   80.56327 2.435844   80.56327 2.435844 
1 1 1   26    0    5 o 34.26836 1.765017   18.40257     0.0   11.84843 1.202886   11.84843 1.202886 
1 1 1   26    0    6 o 16.21398 3.965000   65.63652   180.0   3.067359 1.112669   3.067359 1.112669 
1 1 1   26    0    7 o 44.04034 1.540495   19.31852     0.0   19.48675 1.353247   19.48675 1.353247 
1 1 1   26    0    8 o 44.51093 1.286034   56.12592     0.0   19.87769 1.142741   19.87769 1.142741 
1 1 1   26    0    9 o 18.70923 2.308032   36.02576   180.0   3.668802 0.8420200   3.668802 0.8420200 
1 1 1   26    0   10 o 7.164967 4.083942   1.264429     0.0  0.6916593 0.9021643  0.6916593 0.9021643 
1 1 1   26    0   11 o 46.88543 3.568614   77.64577     0.0   22.64433 3.307936   22.64433 3.307936 
1 1 1   26    0   12 o 63.73869 2.962481   88.29326     0.0   41.31913 3.759018   41.31913 3.759018 
1 1 1   26    0   13 o 9.413918 6.247294   8.544495   180.0 -0.2105050 2.977142 -0.2105050 2.977142 
1 1 1   26    0   14 x        ?      ?   39.06148   180.0          ?        ?          ?        ? 
1 1 1   26    0   15 f 17.96852 7.492383   17.81700   180.0   5.022048 2.676421   5.022048 2.676421 
1 1 1   26    0   16 x        ?      ?   7.011723   180.0          ?        ?          ?        ? 
1 1 1   26    0   17 o 11.96973 7.076982   7.928263     0.0   2.556132 2.856854   2.556132 2.856854 
1 1 1   26    0   18 o 9.094775 6.060153   3.793081   180.0  0.5713707 2.856854  0.5713707 2.856854 
1 1 1   26    1    0 o 29.43450 1.906461   42.43326   180.0   8.781067 1.112669   8.781067 1.112669 
1 1 1   26    1    1 o 67.23563 0.9392565   102.5842   110.0   45.22850 1.263030          ?        ? 
1 1 1   26    1    2 o 102.3554 1.042994   144.2880   185.1   104.8315 2.135122          ?        ? 
1 1 1   26    1    3 o 57.44582 0.9684510   80.40721   125.4   33.01921 1.112669          ?        ? 
1 1 1   26    1    4 o 37.73700 1.195331   61.13390   357.0   14.25420 0.9021643          ?        ? 
1 1 1   26    1    5 o 44.90217 1.105048   64.39712     8.6   20.17841 0.9923807          ?        ? 
1 1 1   26    1    6 o 86.43820 0.8871537   110.1005   193.2   74.75935 1.533679          ?        ? 
1 1 1   26    1    7 o 19.27553 2.028157   33.52179   224.7   3.728946 0.7818757          ?        ? 
1 1 1   26    1    8 o 13.69504 2.731769   28.20645   198.1   1.954689 0.7217315          ?        ? 
1 1 1   26    1    9 f 13.28258 2.150827   5.660636   199.0   1.774257 0.5713707          ?        ? 
1 1 1   26    1   10 o 13.10157 2.834541   29.69178   359.2   1.804329 0.7217315          ?        ? 
1 1 1   26    1   11 o 13.36138 3.190391   31.33376    90.9   1.894545 0.8420200          ?        ? 
1 1 1   26    1   12 o 16.66654 5.208158   27.42518   116.3   2.977142 1.924617          ?        ? 
1 1 1   26    1   13 o 73.19581 1.930972   105.8737    65.1   54.19000 2.826782          ?        ? 
1 1 1   26    1   14 o 36.07895 4.792678   43.59300    60.5   14.16398 3.458297          ?        ? 
1 1 1   26    1   15 o 20.99210 4.499355   26.00977   237.3   5.022048 1.834401          ?        ? 
1 1 1   26    1   16 o 13.67393 4.711678   8.737242   161.6   2.074978 1.563751          ?        ? 
1 1 1   26    1   17 o 8.774523 3.977785   9.856424   268.9 -0.3909379 1.503607          ?        ? 
1 1 1   26    1   18 o 17.23185 5.542645   14.53467   309.1   4.300317 2.165194          ?        ? 
1 1 1   26    2    0 o 9.235977 4.758315   15.00393     0.0   1.263030 1.112669   1.263030 1.112669 
1 1 1   26    2    1 o 104.8675 1.003671   134.7033   342.8   110.0340 2.105050          ?        ? 
1 1 1   26    2    2 o 30.80880 1.415330   50.66655   183.9   9.502798 0.8720922          ?        ? 
1 1 1   26    2    3 o 44.06032 1.057909   84.86338   203.3   19.42661 0.9322364          ?        ? 
1 1 1   26    2    4 o 88.09337 0.9046219   124.2866   180.9   77.64628 1.593824          ?        ? 
1 1 1   26    2    5 o 37.01379 1.178064   70.09493   260.4   13.71290 0.8720922          ?        ? 
1 1 1   26    2    6 o 26.50378 1.531759   21.28037   270.8   7.036882 0.8119479          ?        ? 
1 1 1   26    2    7 o 30.45732 1.382295   40.29191   135.8   9.292293 0.8420200          ?        ? 
1 1 1   26    2    8 o 49.45011 1.033823   55.48500   178.8   24.47873 1.022453          ?        ? 
1 1 1   26    2    9 o 18.15428 1.739301   27.85734   290.5   3.307936 0.6315150          ?        ? 
1 1 1   26    2   10 f 23.79112 1.643209   25.69088   311.3   5.683635 0.7818757          ?        ? 
1 1 1   26    2   11 o 58.29878 1.263779   81.01675   295.0   34.10181 1.473535          ?        ? 
1 1 1   26    2   12 o 21.08509 1.782785   25.93725   252.3   4.480750 0.7518036          ?        ? 
1 1 1   26    2   13 o 23.50555 4.835396   44.07509   336.6   6.104645 2.195267          ?        ? 
1 1 1   26    2   14 o 36.13875 2.746029   44.14851   126.5   13.44225 1.984761          ?        ? 
1 1 1   26    2   15 o 10.27384 4.618290   9.752266   354.3 -0.4811543 1.984761          ?        ? 
1 1 1   26    2   16 o 9.137089 4.308493   8.226819   208.3  -1.744184 2.074978          ?        ? 
1 1 1   26    2   17 o 18.98567 4.365222   21.29606   201.6   4.330389 1.623896          ?        ? 
1 1 1   26    2   18 o 10.32512 4.744750   14.58541   169.8 -0.2105050 2.255411          ?        ? 
1 1 1   26    3    0 o 41.94175 1.618486   44.07682   180.0   17.68242 1.353247   17.68242 1.353247 
1 1 1   26    3    1 o 17.99375 2.339756   16.59529   281.0   3.247792 0.8420200          ?        ? 
1 1 1   26    3    2 o 73.41065 0.9421785   100.0680    34.9   53.91936 1.383319          ?        ? 
1 1 1   26    3    3 o 106.8654 0.9989775   146.1152   297.3   114.2741 2.135122          ?        ? 
1 1 1   26    3    4 o 32.88377 1.326023   46.17889   315.6   10.82597 0.8720922          ?        ? 
1 1 1   26    3    5 o 10.41303 3.397081   19.59200   120.1   1.052525 0.8119479          ?        ? 
1 1 1   26    3    6 o 39.93960 1.167058   61.48520    24.4   15.96831 0.9322364          ?        ? 
1 1 1   26    3    7 o 25.33413 1.721181   57.74675     5.4   6.435439 0.8720922          ?        ? 
1 1 1   26    3    8 o 53.78704 1.006374   72.75610   113.3   28.95948 1.082597          ?        ? 
1 1 1   26    3    9 f 18.61544 2.342389   7.008478   295.0   3.488369 0.8720922          ?        ? 
1 1 1   26    3   10 o 37.82692 1.271989   47.40598   200.5   14.34441 0.9623086          ?        ? 
1 1 1   26    3   11 o 16.49119 3.031010   15.89343     6.8   2.856854 0.9623086          ?        ? 
1 1 1   26    3   12 o 36.90111 1.385396   39.66565    50.9   13.68283 1.022453          ?        ? 
1 1 1   26    3   13 o 11.28223 3.103144   18.05414   218.7   1.353247 0.7217315          ?        ? 
1 1 1   26    3   14 o 14.03629 5.452261   18.97375    58.7   1.684040 2.195267          ?        ? 
1 1 1   26    3   15 o 15.41305 4.501212   10.03885   297.2   2.706493 1.473535          ?        ? 
1 1 1   26    3   16 o 10.03146 4.573618   10.25942   354.1 -0.7217315 2.044906          ?        ? 
1 1 1   26    3   17 o 16.39347 5.391114   14.44553   257.9   3.488369 2.044906          ?        ? 
1 1 1   26    3   18 o 13.00797 4.909904   18.78593   182.7   2.135122 1.744184          ?        ? 
1 1 1   26    4    0 o 59.68113 1.387337   72.89377     0.0   35.69564 1.653968   35.69564 1.653968 
1 1 1   26    4    1 o 8.159613 3.306809   15.02693   142.0  0.2706493 0.8420200          ?        ? 
1 1 1   26    4    2 o 63.12988 0.9527072   78.42850   303.3   39.87567 1.202886          ?        ? 
1 1 1   26    4    3 o 168.5865 1.275404   227.4058   151.6   284.5125 4.300317          ?        ? 
1 1 1   26    4    4 o 42.60081 1.129449   54.95530   136.5   18.16358 0.9623086          ?        ? 
1 1 1   26    4    5 o 50.74509 1.096332   69.20390    36.5   25.77183 1.112669          ?        ? 
1 1 1   26    4    6 o 13.65068 3.329587   20.42028    12.3   1.954689 0.9021643          ?        ? 
1 1 1   26    4    7 o 85.88442 0.9804107   116.1483   349.5   73.82712 1.684040          ?        ? 
1 1 1   26    4    8 o 42.41599 1.098921   58.16241   347.0   18.01322 0.9322364          ?        ? 
1 1 1   26    4    9 o 31.97938 1.504577   47.17677   199.2   10.25460 0.9623086          ?        ? 
1 1 1   26    4   10 o 29.27350 1.540923   52.23907   284.9   8.600634 0.9021643          ?        ? 
1 1 1   26    4   11 o 19.92141 1.886924   30.75278    73.6   3.999595 0.7518036          ?        ? 
1 1 1   26    4   12 o 24.12944 2.180997   33.99118   100.0   5.894140 1.052525          ?        ? 
1 1 1   26    4   13 f 45.42410 1.324061   59.54620   357.1   20.74978 1.202886          ?        ? 
1 1 1   26    4   14 f 20.60752 2.188920   22.77413   228.1   4.330389 0.9021643          ?        ? 
1 1 1   26    4   15 o 11.77894 2.837776   18.35874   322.1   1.503607 0.6615872          ?        ? 
1 1 1   26    4   16 o 13.24861 5.308296   5.770244   284.0   1.563751 2.135122          ?        ? 
1 1 1   26    4   17 o 14.23708 6.290062   16.18814   138.6   1.593824 3.518441          ?        ? 
1 1 1   26    4   18 o 19.93937 5.380147   18.97187   135.9   5.593419 2.195267          ?        ? 
1 1 1   26    5    0 o 52.32313 1.439255   48.17939   180.0   27.45587 1.503607   27.45587 1.503607 
1 1 1   26    5    1 f 28.10403 1.498042   46.61009   164.2   7.908974 0.8420200          ?        ? 
1 1 1   26    5    2 o 66.28764 0.9526888   97.90086    22.3   43.96547 1.263030          ?        ? 
1 1 1   26    5    3 o 40.31104 1.342805   34.90697    33.7   16.26903 1.082597          ?        ? 
1 1 1   26    5    4 o 41.81595 1.186606   81.72094   251.2   17.50199 0.9923807          ?        ? 
1 1 1   26    5    5 o 82.28059 1.041626   124.6101   223.6   67.75254 1.714112          ?        ? 
1 1 1   26    5    6 o 61.28461 1.030463   91.05650   264.7   37.59018 1.263030          ?        ? 
1 1 1   26    5    7 o 28.88038 1.561898   45.73807   178.9   8.360056 0.9021643          ?        ? 
1 1 1   26    5    8 o 28.04046 1.394192   37.80950   113.0   7.878902 0.7818757          ?        ? 
1 1 1   26    5    9 o 13.20953 3.479845   12.90620   134.7   1.834401 0.9322364          ?        ? 
1 1 1   26    5   10 o 26.63440 1.750061   40.13576   283.8   7.127099 0.9322364          ?        ? 
1 1 1   26    5   11 o 26.33359 1.655855   36.04933   244.8   6.976738 0.8720922          ?        ? 
1 1 1   26    5   12 o 57.34053 1.258676   67.35967   223.6   33.01921 1.443463          ?        ? 
1 1 1   26    5   13 o 31.71111 2.038879   42.79313   162.1   10.19446 1.293102          ?        ? 
1 1 1   26    5   14 o 21.16868 2.486044   19.92840   289.9   4.601038 1.052525          ?        ? 
1 1 1   26    5   15 o 6.531708 3.122497   10.09408   329.1  -1.383319 1.142741          ?        ? 
1 1 1   26    5   16 o 18.51926 2.273363   30.85644    81.1   3.548513 0.8420200          ?        ? 
1 1 1   26    5   17 o 17.60235 2.306362   23.47579    61.9   3.247792 0.8119479          ?        ? 
1 1 1   26    5   18 o 12.52391 3.223315   22.40153   268.1   1.834401 0.8119479          ?        ? 
1 1 1   26    6    0 o 31.85439 1.805841   52.98640     0.0   10.25460 1.142741   10.25460 1.142741 
1 1 1   26    6    1 o 17.73837 2.373443   8.682389   341.2   3.157575 0.8420200          ?        ? 
1 1 1   26    6    2 o 9.263736 3.562359   18.85897   106.1  0.5713707 0.9322364          ?        ? 
1 1 1   26    6    3 o 137.1914 1.227512   185.5141   334.1   188.4020 3.368080          ?        ? 
1 1 1   26    6    4 o 57.77964 1.066949   81.38927   109.3   33.41015 1.232958          ?        ? 
1 1 1   26    6    5 o 16.31742 2.672273   28.77055    78.6   2.676421 0.8720922          ?        ? 
1 1 1   26    6    6 o 44.11598 1.226990   81.16772   280.3   19.48675 1.082597          ?        ? 
1 1 1   26    6    7 o 42.19912 1.211462   68.01437   342.7   17.83278 1.022453          ?        ? 
1 1 1   26    6    8 o 6.508400 2.803023   12.75453    56.4      -0.06 0.6615872          ?        ? 
1 1 1   26    6    9 o 54.78391 1.262523   92.54177    60.0   30.07215 1.383319          ?        ? 
1 1 1   26    6   10 o 88.43992 1.122096   105.8638   140.3   78.36801 1.984761          ?        ? 
1 1 1   26    6   11 o 33.13857 1.497320   48.04127   250.6   11.03648 0.9923807          ?        ? 
1 1 1   26    6   12 o 13.73960 4.016758   20.03971   307.2   2.014834 1.172814          ?        ? 
1 1 1   26    6   13 o 34.24936 1.712169   46.79638   277.4   11.84843 1.172814          ?        ? 
1 1 1   26    6   14 o 17.10777 3.707911   17.80168   268.0   3.217719 1.232958          ?        ? 
1 1 1   26    6   15 o 30.39058 2.325377   44.69098   316.9   9.532870 1.413391          ?        ? 
1 1 1   26    6   16 o 16.15718 4.230939   33.96111   299.4   3.037287 1.383319          ?        ? 
1 1 1   26    6   17 o 9.236484 3.683742   11.98960    75.3  0.6615872 1.022453          ?        ? 
1 1 1   26    6   18 o 12.66185 3.543130   9.312711   301.4   1.924617 0.9322364          ?        ? 
1 1 1   26    7    0 o 52.75085 1.685514   52.05539   360.0   27.93702 1.774257   27.93702 1.774257 
1 1 1   26    7    1 o 6.041850 2.882838   13.46658    84.8  -1.263030 0.9623086          ?        ? 
1 1 1   26    7    2 o 67.47112 1.091975   70.53909   299.3   45.55930 1.473535          ?        ? 
1 1 1   26    7    3 o 30.80024 1.610995   43.12672   132.4   9.502798 0.9923807          ?        ? 
1 1 1   26    7    4 o 88.84721 1.066182   106.9842   319.7   78.99953 1.894545          ?        ? 
1 1 1   26    7    5 o 84.06657 1.037383   148.7050   232.4   70.72968 1.744184          ?        ? 
1 1 1   26    7    6 o 36.75706 1.349918   53.45663   209.9   13.53246 0.9923807          ?        ? 
1 1 1   26    7    7 o 18.29862 2.465115   11.02980    13.8   3.368080 0.9021643          ?        ? 
1 1 1   26    7    8 o 60.26534 1.247489   85.47173   359.0   36.38729 1.503607          ?        ? 
1 1 1   26    7    9 o 61.15553 1.180158   83.84124    76.0   37.46989 1.443463          ?        ? 
1 1 1   26    7   10 o 19.02856 2.844664   34.59801     5.7   3.668802 1.082597          ?        ? 
1 1 1   26    7   11 o 16.04662 3.385056   40.81345   260.5   2.736565 1.052525          ?        ? 
1 1 1   26    7   12 o 54.57638 1.267324   68.01067   241.2   29.92178 1.383319          ?        ? 
1 1 1   26    7   13 o 22.87717 2.826185   38.07765   238.6   5.382914 1.293102          ?        ? 
1 1 1   26    7   14 o 10.26646 4.180763   6.811539   265.5  0.6014429 1.353247          ?        ? 
1 1 1   26    7   15 o 23.02213 3.134948   33.28320   143.8   5.623491 1.443463          ?        ? 
1 1 1   26    7   16 o 19.26587 3.960072   23.72323    20.5   4.240172 1.473535          ?        ? 
1 1 1   26    7   17 o 13.64344 3.818316   28.78091   111.9   2.195267 1.082597          ?        ? 
1 1 1   26    7   18 o 19.72177 3.049640   22.29259   119.9   4.360461 1.202886          ?        ? 
1 1 1   26    8    0 o 91.06580 1.668885   96.32993   180.0   83.08933 3.037287   83.08933 3.037287 
1 1 1   26    8    1 o 53.62156 1.177726   82.97771   211.4   28.77904 1.263030          ?        ? 
1 1 1   26    8    2 o 75.34107 1.077696   97.17746   163.8   56.80628 1.623896          ?        ? 
1 1 1   26    8    3 o 54.89369 1.205216   89.23501   141.1   30.16236 1.323174          ?        ? 
1 1 1   26    8    4 o 36.30690 1.449484   50.58568    51.9   13.20167 1.052525          ?        ? 
1 1 1   26    8    5 o 43.07957 1.326315   46.03802   172.4   18.58459 1.142741          ?        ? 
1 1 1   26    8    6 o 14.35317 3.400177   34.87937   305.0   2.165194 0.9623086          ?        ? 
1 1 1   26    8    7 o 40.04091 1.276760   56.71227   148.3   16.05853 1.022453          ?        ? 
1 1 1   26    8    8 o 35.64894 1.644949   39.53267   320.5   12.75059 1.172814          ?        ? 
1 1 1   26    8    9 o 11.44173 3.922490   14.99686   282.7   1.232958 1.082597          ?        ? 
1 1 1   26    8   10 o 36.33435 1.572536   44.30732   306.1   13.26182 1.142741          ?        ? 
1 1 1   26    8   11 o 29.46212 1.888305   49.20447    93.4   8.750995 1.112669          ?        ? 
1 1 1   26    8   12 o 14.08922 3.526611   20.43079   217.8   2.135122 0.9923807          ?        ? 
1 1 1   26    8   13 o 14.74840 4.377433   13.47978   285.8   2.375700 1.383319          ?        ? 
1 1 1   26    8   14 o 9.538013 3.978818   17.22697    64.8  0.3608657 1.263030          ?        ? 
1 1 1   26    8   15 o 13.21912 4.231394   14.80098   146.5   1.954689 1.263030          ?        ? 
1 1 1   26    8   16 o 15.05865 4.349531   31.91365    51.5   2.676421 1.383319          ?        ? 
1 1 1   26    8   17 o 13.05982 4.690434   13.61325   351.2   2.044906 1.563751          ?        ? 
1 1 1   26    9    0 o 36.45359 2.118525   58.50755   180.0   13.44225 1.533679   13.44225 1.533679 
1 1 1   26    9    1 o 49.81537 1.207344   92.82941   291.1   24.83959 1.202886          ?        ? 
1 1 1   26    9    2 f 27.05776 1.833819   74.61526   302.4   7.337603 0.9923807          ?        ? 
1 1 1   26    9    3 f 74.45515 1.110714   111.4739   250.7   55.48311 1.653968          ?        ? 
1 1 1   26    9    4 o 32.13445 1.544107   39.86070   309.2   10.34482 0.9923807          ?        ? 
1 1 1   26    9    5 o 81.78757 1.176595   89.03946   103.6   66.97066 1.924617          ?        ? 
1 1 1   26    9    6 o 61.68921 1.121200   78.74748    18.6   38.10141 1.383319          ?        ? 
1 1 1   26    9    7 o 38.36220 1.097461   53.43295    46.0   14.73535 0.8420200          ?        ? 
1 1 1   26    9    8 o 13.51804 3.969077   6.096429   198.5   1.894545 1.142741          ?        ? 
1 1 1   26    9    9 o 22.62012 2.658884   37.28218   221.4   5.172409 1.202886          ?        ? 
1 1 1   26    9   10 o 38.91641 1.506837   56.38241   338.8   15.21651 1.172814          ?        ? 
1 1 1   26    9   11 f 17.63554 3.186074   27.30324    17.0   3.277864 1.082597          ?        ? 
1 1 1   26    9   12 o 26.87993 1.957827   39.38855   197.3   7.307531 1.052525          ?        ? 
1 1 1   26    9   13 o 10.14784 4.103949   24.50203   245.0  0.5713707 1.293102          ?        ? 
1 1 1   26    9   14 o 29.05346 2.535903   39.04949   117.4   8.720922 1.473535          ?        ? 
1 1 1   26    9   15 o 10.49249 4.122587   3.916538    28.3  0.8720922 1.263030          ?        ? 
1 1 1   26    9   16 o 9.194542 3.984922   11.59055   190.5  0.1503607 1.353247          ?        ? 
1 1 1   26    9   17 f 11.83767 4.499740   11.05211   149.6   1.563751 1.473535          ?        ? 
1 1 1   26   10    0 o 81.25103 1.648520   82.44697    -0.0   66.15872 2.676421   66.15872 2.676421 
1 1 1   26   10    1 o 126.5637 1.330588   196.8867   302.8   160.3747 3.368080          ?        ? 
1 1 1   26   10    2 o 52.74131 1.254401   63.13603   124.6   27.84681 1.323174          ?        ? 
1 1 1   26   10    3 o 39.09772 1.346018   50.19877   193.8   15.30672 1.052525          ?        ? 
1 1 1   26   10    4 o 38.19879 1.417057   54.59873   113.0   14.61506 1.082597          ?        ? 
1 1 1   26   10    5 o 35.88078 1.508603   56.21116   330.0   12.90095 1.082597          ?        ? 
1 1 1   26   10    6 o 16.56083 3.110703   13.01473    12.4   2.856854 0.9923807          ?        ? 
1 1 1   26   10    7 o 22.76941 1.716943   40.69565   319.3   5.202481 0.7818757          ?        ? 
1 1 1   26   10    8 o 42.45173 1.523027   61.97389    69.3   18.07336 1.293102          ?        ? 
1 1 1   26   10    9 o 16.34078 3.593915   22.84907   338.4   2.826782 1.142741          ?        ? 
1 1 1   26   10   10 o 32.77505 1.880940   53.42696   127.9   10.82597 1.232958          ?        ? 
1 1 1   26   10   11 o 10.59760 3.980114   43.27079    91.3  0.9021643 1.142741          ?        ? 
1 1 1   26   10   12 o 18.64650 3.064226   13.82060     4.6   3.578585 1.142741          ?        ? 
1 1 1   26   10   13 o 46.05795 1.567008   55.01476   331.8   21.41137 1.443463          ?        ? 
1 1 1   26   10   14 o 29.13284 2.580606   37.08663   248.8   8.781067 1.503607          ?        ? 
1 1 1   26   10   15 o 19.98047 3.901873   27.33220   236.4   4.480750 1.503607          ?        ? 
1 1 1   26   10   16 o 26.60183 2.713090   31.94153   222.8   7.518036 1.443463          ?        ? 
1 1 1   26   10   17 o 9.408783 4.075069   14.26463    53.6  0.3608657 1.413391          ?        ? 
1 1 1   26   11    0 o 103.4618 1.817874   167.4804   180.0   107.2673 3.759018   107.2673 3.759018 
1 1 1   26   11    1 o 95.07818 1.170268   113.4904    26.1   90.48708 2.225339          ?        ? 
1 1 1   26   11    2 o 30.55365 1.574785   48.93231   140.2   9.352437 0.9623086          ?        ? 
1 1 1   26   11    3 o 33.41399 1.574977   42.34858    24.3   11.18684 1.052525          ?        ? 
1 1 1   26   11    4 o 46.88433 1.282823   63.27725   179.5   22.01281 1.202886          ?        ? 
1 1 1   26   11    5 o 34.94247 1.592145   38.47808   248.2   12.23936 1.112669          ?        ? 
1 1 1   26   11    6 o 30.69536 1.469545   55.28099   153.5   9.442654 0.9021643          ?        ? 
1 1 1   26   11    7 o 40.49010 1.114056   66.91749   267.6   16.41939 0.9021643          ?        ? 
1 1 1   26   11    8 f 39.88415 1.168680   46.07176   317.5   15.93824 0.9322364          ?        ? 
1 1 1   26   11    9 o 25.61146 2.289627   28.85756     4.5   6.615872 1.172814          ?        ? 
1 1 1   26   11   10 o 12.87409 4.287043   13.31701   143.3   1.653968 1.293102          ?        ? 
1 1 1   26   11   11 o 49.94210 1.415029   72.16406   193.7   25.08017 1.413391          ?        ? 
1 1 1   26   11   12 o 23.12236 2.666159   24.76104   164.8   5.473131 1.232958          ?        ? 
1 1 1   26   11   13 o 52.97044 1.334132   67.33010   178.0   28.26782 1.413391          ?        ? 
1 1 1   26   11   14 o 27.46671 2.737144   37.18284   144.4   7.848830 1.503607          ?        ? 
1 1 1   26   11   15 o 13.28031 4.482013   13.80765   347.2   1.954689 1.413391          ?        ? 
1 1 1   26   11   16 o 24.02596 2.565887   31.37432    40.4   6.104645 1.232958          ?        ? 
1 1 1   26   11   17 o 10.37210 4.310325   10.43199   334.0  0.8720922 1.473535          ?        ? 
1 1 1   26   12    0 o 7.592644 4.787814   6.223459   180.0  0.3307936 1.503607  0.3307936 1.503607 
1 1 1   26   12    1 o 34.47956 1.482694   32.67611   107.8   11.90857 1.022453          ?        ? 
1 1 1   26   12    2 o 33.55368 1.433984   43.13173   282.1   11.27705 0.9623086          ?        ? 
1 1 1   26   12    3 o 20.61028 2.480444   28.21914   296.9   4.270245 1.022453          ?        ? 
1 1 1   26   12    4 o 81.00838 1.169351   109.2731   340.8   65.70763 1.894545          ?        ? 
1 1 1   26   12    5 o 45.51337 1.321464   49.85135    71.4   20.74978 1.202886          ?        ? 
1 1 1   26   12    6 o 48.24509 1.059644   59.53327   258.9   23.30591 1.022453          ?        ? 
1 1 1   26   12    7 o 53.24932 0.9882990   70.27725   258.2   28.38811 1.052525          ?        ? 
1 1 1   26   12    8 o 24.89108 1.751817   28.62426   266.8   6.224934 0.8720922          ?        ? 
1 1 1   26   12    9 o 25.96948 2.489657   41.31332    14.8   6.826377 1.293102          ?        ? 
1 1 1   26   12   10 o 22.82495 2.635023   46.37645    82.9   5.292697 1.202886          ?        ? 
1 1 1   26   12   11 o 31.61508 1.949952   42.14754   126.0   10.10424 1.232958          ?        ? 
1 1 1   26   12   12 f 52.75704 1.396529   70.86598    98.2   28.02724 1.473535          ?        ? 
1 1 1   26   12   13 o 26.02904 2.310661   36.66024    42.0   6.946666 1.202886          ?        ? 
1 1 1   26   12   14 o 10.85831 4.358778   16.82766   313.8  0.8420200 1.443463          ?        ? 
1 1 1   26   12   15 o 8.493090 3.906965   11.03427   353.8 -0.8119479 1.533679          ?        ? 
1 1 1   26   12   16 o 22.92609 3.213664   39.44694    99.3   5.743780 1.473535          ?        ? 
1 1 1   26   12   17 f 10.54420 4.390598   18.46380   184.8  0.9322364 1.533679          ?        ? 
1 1 1   26   13    0 o 4.461624 3.230555   2.150422   180.0  -2.285483 1.383319  -2.285483 1.383319 
1 1 1   26   13    1 o 55.72799 1.214153   62.49842   154.1   31.09460 1.353247          ?        ? 
1 1 1   26   13    2 o 43.17943 1.358070   55.88862   124.4   18.67480 1.172814          ?        ? 
1 1 1   26   13    3 f 10.79819 3.698271   21.21530   139.4   1.082597 0.9623086          ?        ? 
1 1 1   26   13    4 o 42.89838 1.331917   67.04099   154.7   18.43423 1.142741          ?        ? 
1 1 1   26   13    5 o 51.32674 1.025319   89.56725   179.1   26.37327 1.052525          ?        ? 
1 1 1   26   13    6 o 30.34609 1.436910   47.26653   195.9   9.232149 0.8720922          ?        ? 
1 1 1   26   13    7 o 24.35623 1.666818   13.59159    40.3   5.954284 0.8119479          ?        ? 
1 1 1   26   13    8 o 20.47379 1.689134   30.50733   131.2   4.210100 0.6916593          ?        ? 
1 1 1   26   13    9 o 29.48442 2.141860   39.66584   102.2   8.781067 1.263030          ?        ? 
1 1 1   26   13   10 o 15.22318 3.998096   28.53209   147.1   2.495988 1.232958          ?        ? 
1 1 1   26   13   11 o 18.31253 3.491787   21.04306   332.5   3.578585 1.232958          ?        ? 
1 1 1   26   13   12 o 16.46705 3.657272   27.00799   293.9   2.947070 1.172814          ?        ? 
1 1 1   26   13   13 f 31.08171 2.031790   46.54028    57.2   9.863664 1.263030          ?        ? 
1 1 1   26   13   14 o 34.16832 2.288306   40.26561   104.0   12.05893 1.563751          ?        ? 
1 1 1   26   13   15 o 10.84165 4.409619   12.45937   136.0  0.8420200 1.503607          ?        ? 
1 1 1   26   13   16 o 8.359084 3.854518   4.167058   205.0 -0.6916593 1.503607          ?        ? 
1 1 1   26   13   17 o 11.97246 4.547047   13.95300   286.9   1.714112 1.503607          ?        ? 
1 1 1   26   14    0 o 48.29410 1.811346   70.69943   180.0   23.45627 1.744184   23.45627 1.744184 
1 1 1   26   14    1 o 50.24770 1.346576   61.32454   320.2   25.29067 1.353247          ?        ? 
1 1 1   26   14    2 o 80.49115 1.120824   103.7966   319.3   64.86562 1.804329          ?        ? 
1 1 1   26   14    3 o 20.52664 2.563803   31.37228    40.7   4.240172 1.052525          ?        ? 
1 1 1   26   14    4 o 30.19444 1.643317   43.27514   184.3   9.141932 0.9923807          ?        ? 
1 1 1   26   14    5 o 30.88690 1.411751   30.37918   352.4   9.562942 0.8720922          ?        ? 
1 1 1   26   14    6 o 24.97034 1.625825   20.25456     0.3   6.255006 0.8119479          ?        ? 
1 1 1   26   14    7 o 12.74683 3.093809   24.68759    84.1   1.714112 0.7818757          ?        ? 
1 1 1   26   14    8 o 11.69758 2.953998   9.178748   112.8   1.443463 0.6916593          ?        ? 
1 1 1   26   14    9 o 8.517520 3.747134   14.09407   316.4 -0.2706493 1.232958          ?        ? 
1 1 1   26   14   10 o 12.49440 4.186158   5.659017   191.1   1.563751 1.232958          ?        ? 
1 1 1   26   14   11 o 52.02327 1.445130   70.97642   290.0   27.24536 1.503607          ?        ? 
1 1 1   26   14   12 o 23.29174 2.582216   26.10783   333.3   5.563347 1.202886          ?        ? 
1 1 1   26   14   13 o 8.683972 3.735934   6.693082   133.6       0.06 1.172814          ?        ? 
1 1 1   26   14   14 o 31.04160 2.615677   42.65224   100.2   10.04410 1.623896          ?        ? 
1 1 1   26   14   15 o 13.78758 4.668845   24.41873   250.8   2.225339 1.533679          ?        ? 
1 1 1   26   14   16 o 32.52105 2.450450   44.63514   244.3   11.24698 1.593824          ?        ? 
1 1 1   26   15    0 f 34.33469 2.253258   84.94261    -0.0   11.96871 1.533679   11.96871 1.533679 
1 1 1   26   15    1 o 52.64442 1.256709   72.60159   165.1   27.75659 1.323174          ?        ? 
1 1 1   26   15    2 o 49.28258 1.311926   69.90442    95.8   24.32837 1.293102          ?        ? 
1 1 1   26   15    3 o 46.10216 1.304587   71.91438   359.5   21.29108 1.202886          ?        ? 
1 1 1   26   15    4 o 42.26348 1.209617   64.24470   314.9   17.89293 1.022453          ?        ? 
1 1 1   26   15    5 o 10.07616 3.397082   14.15846   280.4  0.9623086 0.8119479          ?        ? 
1 1 1   26   15    6 f 18.36654 2.292267   12.88818   225.0   3.398152 0.8420200          ?        ? 
1 1 1   26   15    7 o 16.92712 2.220708   19.72401   237.5   2.886926 0.7518036          ?        ? 
1 1 1   26   15    8 o 52.88426 0.9951212   71.29833   270.1   28.02724 1.052525          ?        ? 
1 1 1   26   15    9 o 40.29369 1.567280   54.12249   252.5   16.32917 1.263030          ?        ? 
1 1 1   26   15   10 o 40.31339 1.715706   60.70038    69.7   16.38932 1.383319          ?        ? 
1 1 1   26   15   11 o 11.60004 4.210484   8.586857   136.9   1.232958 1.263030          ?        ? 
1 1 1   26   15   12 o 21.05385 2.928106   26.19415    19.9   4.601038 1.232958          ?        ? 
1 1 1   26   15   13 o 26.55278 2.434966   35.35562    39.2   7.277459 1.293102          ?        ? 
1 1 1   26   15   14 o 11.05845 4.444698   15.28690    25.7  0.9021643 1.503607          ?        ? 
1 1 1   26   15   15 o 11.96406 4.611083   23.60049   183.0   1.443463 1.563751          ?        ? 
1 1 1   26   15   16 o 9.540619 4.188310   12.03582   160.0  0.2706493 1.533679          ?        ? 
1 1 1   26   16    0 o 8.678826 5.045668       0.05     0.0  0.9623086 1.413391  0.9623086 1.413391 
1 1 1   26   16    1 o 48.54451 1.300899   74.71085   125.6   23.60663 1.263030          ?        ? 
1 1 1   26   16    2 o 78.55341 1.167614   105.4507   217.4   61.79826 1.834401          ?        ? 
1 1 1   26   16    3 o 58.45857 1.080278   63.36590   190.2   34.22210 1.263030          ?        ? 
1 1 1   26   16    4 o 34.28808 1.490974   61.42804    82.8   11.78828 1.022453          ?        ? 
1 1 1   26   16    5 o 13.85994 2.912944   20.64112   113.2   2.014834 0.7818757          ?        ? 
1 1 1   26   16    6 o 43.48547 1.106471   61.41337   117.2   18.94545 0.9623086          ?        ? 
1 1 1   26   16    7 o 37.42511 1.205293   55.33288   187.7   14.04369 0.9021643          ?        ? 
1 1 1   26   16    8 o 54.09117 0.9729178   77.92504   116.1   29.32034 1.052525          ?        ? 
1 1 1   26   16    9 o 10.36942 4.140469   14.98626    69.1  0.6315150 1.293102          ?        ? 
1 1 1   26   16   10 o 8.248631 3.696693   13.03171    78.3 -0.4811543 1.263030          ?        ? 
1 1 1   26   16   11 o 31.79265 1.986356   32.12748   106.4   10.25460 1.263030          ?        ? 
1 1 1   26   16   12 o 12.50296 4.186158   25.34533    18.0   1.653968 1.232958          ?        ? 
1 1 1   26   16   13 o 11.70559 4.122759   25.26438   163.3   1.413391 1.202886          ?        ? 
1 1 1   26   16   14 o 17.21490 3.687829   17.55859   254.9   3.338008 1.232958          ?        ? 
1 1 1   26   16   15 o 17.18697 4.497404   15.05826    92.0   3.608657 1.563751          ?        ? 
1 1 1   26   16   16 o 25.81274 3.145532   29.04824   308.7   7.457891 1.623896          ?        ? 
1 1 1   26   17    0 o 55.16898 1.748152   42.88996   180.0   30.58337 1.924617   30.58337 1.924617 
1 1 1   26   17    1 o 77.21024 1.226874   93.63325   178.0   59.72328 1.894545          ?        ? 
1 1 1   26   17    2 o 23.18414 2.399634   20.67972   258.0   5.412986 1.112669          ?        ? 
1 1 1   26   17    3 f 31.30855 1.632865   26.58115   280.7   9.833591 1.022453          ?        ? 
1 1 1   26   17    4 o 44.94498 1.204358   69.44119   291.8   20.23855 1.082597          ?        ? 
1 1 1   26   17    5 o 18.59318 2.426062   21.16465   342.1   3.488369 0.9021643          ?        ? 
1 1 1   26   17    6 o 37.78765 1.233520   51.37823    43.2   14.31434 0.9322364          ?        ? 
1 1 1   26   17    7 o 36.51622 1.276469   41.95046   155.4   13.38210 0.9322364          ?        ? 
1 1 1   26   17    8 o 9.620354 3.202795   19.27277   317.6  0.9021643 0.7217315          ?        ? 
1 1 1   26   17    9 o 12.49276 2.723439   29.39329    35.3   1.653968 0.6615872          ?        ? 
1 1 1   26   17   10 o 13.79276 4.140634   17.72073   268.9   2.044906 1.232958          ?        ? 
1 1 1   26   17   11 o 13.56777 4.214943   20.87723   263.6   1.984761 1.263030          ?        ? 
1 1 1   26   17   12 o 11.18016 4.104001   15.76762   350.5   1.172814 1.202886          ?        ? 
1 1 1   26   17   13 f 11.54264 4.022894   32.59469   201.7   1.383319 1.142741          ?        ? 
1 1 1   26   17   14 o 18.33152 3.488622   23.19185   283.4   3.759018 1.232958          ?        ? 
1 1 1   26   17   15 o 7.110807 3.447690   17.35770   251.8  -2.074978 1.533679          ?        ? 
1 1 1   26   17   16 o 8.360331 3.854874   6.586147   244.3 -0.5112265 1.503607          ?        ? 
1 1 1   26   18    0 o 36.21485 2.345217   27.74246   180.0   13.32196 1.684040   13.32196 1.684040 
1 1 1   26   18    1 o 65.95115 1.231135   83.41877   236.4   43.57454 1.623896          ?        ? 
1 1 1   26   18    2 o 25.49304 1.828413   42.18374   188.5   6.525656 0.9322364          ?        ? 
1 1 1   26   18    3 o 32.62167 1.521045   57.95384   242.1   10.67561 0.9923807          ?        ? 
1 1 1   26   18    4 o 50.38388 1.193721   72.50486   213.2   25.44103 1.202886          ?        ? 
1 1 1   26   18    5 o 8.955091 3.491791   22.95013   246.2  0.5112265 0.9021643          ?        ? 
1 1 1   26   18    6 o 18.23541 2.473660   32.82975   358.4   3.368080 0.9021643          ?        ? 
1 1 1   26   18    7 o 9.526258 3.383945   20.74448    44.4  0.8119479 0.8119479          ?        ? 
1 1 1   26   18    8 o 10.87043 3.227222   25.60028   231.2   1.232958 0.7518036          ?        ? 
1 1 1   26   18    9 o 38.71246 1.048691   62.29961   324.4   15.03607 0.8119479          ?        ? 
1 1 1   26   18   10 o 10.02896 4.085879   18.42021    45.0  0.5112265 1.293102          ?        ? 
1 1 1   26   18   11 o 30.93009 2.138976   47.44565   250.6   9.773447 1.323174          ?        ? 
1 1 1   26   18   12 o 22.45496 2.812362   18.15932   140.1   5.262625 1.263030          ?        ? 
1 1 1   26   18   13 o 16.50380 3.563340   26.43615    40.0   3.037287 1.142741          ?        ? 
1 1 1   26   18   14 o 10.36121 4.167406   9.354329    83.3  0.8420200 1.323174          ?        ? 
1 1 1   26   18   15 o 10.61365 4.403226   20.03424    22.6  0.9021643 1.533679          ?        ? 
1 1 1   26   19    0 o 39.83302 2.165085   40.96525     0.0   16.05853 1.714112   16.05853 1.714112 
1 1 1   26   19    1 o 44.66368 1.312939   58.07754   295.4   19.99798 1.172814          ?        ? 
1 1 1   26   19    2 o 51.88154 1.188244   88.79714   326.2   26.97471 1.232958          ?        ? 
1 1 1   26   19    3 o 22.13258 2.106028   40.34061   304.4   4.931832 0.9322364          ?        ? 
1 1 1   26   19    4 o 51.30157 1.143058   54.93960    70.4   26.37327 1.172814          ?        ? 
1 1 1   26   19    5 o 29.18916 1.699913   36.12098   253.1   8.570561 0.9923807          ?        ? 
1 1 1   26   19    6 o 17.02527 2.737802   24.85088   273.0   2.947070 0.9322364          ?        ? 
1 1 1   26   19    7 o 16.41945 2.472518   26.11595    36.3   2.736565 0.8119479          ?        ? 
1 1 1   26   19    8 o 31.55837 1.381713   35.05559   219.8   10.01402 0.8720922          ?        ? 
1 1 1   26   19    9 o 23.73235 1.647278   27.89985    23.1   5.683635 0.7818757          ?        ? 
1 1 1   26   19   10 o 10.57109 4.129567   7.098277   128.5  0.8119479 1.263030          ?        ? 
1 1 1   26   19   11 o 23.49140 2.816295   23.48886   333.1   5.743780 1.323174          ?        ? 
1 1 1   26   19   12 o 8.562995 3.777803   15.07506   335.8 -0.1503607 1.263030          ?        ? 
1 1 1   26   19   13 o 7.208997 3.302066   10.13308   211.9 -0.6014429 1.082597          ?        ? 
1 1 1   26   19   14 o 23.11419 2.797204   26.97184   288.9   5.713707 1.293102          ?        ? 
1 1 1   26   19   15 o 9.017487 4.037536   16.68382   156.2      -0.03 1.503607          ?        ? 
1 1 1   26   20    0 o 10.11449 5.282230   12.17695   180.0   1.533679 1.383319   1.533679 1.383319 
1 1 1   26   20    1 o 63.93647 1.128826   73.30151    88.7   40.95826 1.443463          ?        ? 
1 1 1   26   20    2 o 30.32156 1.636428   33.21211   193.0   9.232149 0.9923807          ?        ? 
1 1 1   26   20    3 o 42.20433 1.282567   50.85298    77.8   17.86285 1.082597          ?        ? 
1 1 1   26   20    4 o 15.68855 2.982865   31.41385   242.0   2.586205 0.9021643          ?        ? 
1 1 1   26   20    5 o 31.79546 1.560570   41.72951    53.9   10.16438 0.9923807          ?        ? 
1 1 1   26   20    6 o 26.13042 1.898899   42.43497   171.3   6.886521 0.9923807          ?        ? 
1 1 1   26   20    7 o 8.673773 3.327587   10.59568    77.7  0.5412986 0.8119479          ?        ? 
1 1 1   26   20    8 o 23.65294 1.843518   36.31754   301.1   5.653563 0.8720922          ?        ? 
1 1 1   26   20    9 o 25.12922 1.615545   31.64344   172.8   6.375295 0.8119479          ?        ? 
1 1 1   26   20   10 f 37.21114 1.091001   42.21203   106.8   13.92340 0.8119479          ?        ? 
1 1 1   26   20   11 o 5.986314 2.938662   4.945085   311.4  -2.255411 1.202886          ?        ? 
1 1 1   26   20   12 o 19.99811 3.308249   26.39446   338.3   4.270245 1.323174          ?        ? 
1 1 1   26   20   13 o 26.45098 2.387492   42.94769   214.9   7.307531 1.263030          ?        ? 
1 1 1   26   20   14 o 6.995394 3.282838   12.57904   353.6 -0.9322364 1.172814          ?        ? 
1 1 1   26   20   15 o 8.740247 4.004754   6.327603   128.4 -0.3909379 1.593824          ?        ? 
1 1 1   26   21    0 f 50.14556 1.472056   64.53730     0.0   25.26060 1.473535   25.26060 1.473535 
1 1 1   26   21    1 o 31.85104 1.605054   34.37480   319.4   10.19446 1.022453          ?        ? 
1 1 1   26   21    2 o 28.24626 1.756659   39.87642    16.5   8.029263 0.9923807          ?        ? 
1 1 1   26   21    3 o 20.22966 2.527113   18.86048   105.6   4.149956 1.022453          ?        ? 
1 1 1   26   21    4 o 10.98181 3.698273   16.71047   137.6   1.172814 0.9623086          ?        ? 
1 1 1   26   21    5 o 6.888459 3.126505   15.73652   221.7 -0.5112265 0.9322364          ?        ? 
1 1 1   26   21    6 f 10.11345 3.515356   8.673863   176.5  0.9623086 0.8720922          ?        ? 
1 1 1   26   21    7 o 37.41707 1.326107   44.81629   262.9   14.07376 0.9923807          ?        ? 
1 1 1   26   21    8 o 33.27118 1.491352   37.64529    50.5   11.15676 0.9923807          ?        ? 
1 1 1   26   21    9 o 37.32754 1.208444   39.79729   347.6   14.01362 0.9021643          ?        ? 
1 1 1   26   21   10 o 9.706279 3.202798   9.613688    75.2  0.9623086 0.7217315          ?        ? 
1 1 1   26   21   11 o 31.59579 2.093910   48.10533   163.1   10.25460 1.323174          ?        ? 
1 1 1   26   21   12 o 8.396956 3.731676   3.853474   130.4 -0.2405772 1.263030          ?        ? 
1 1 1   26   21   13 o 7.295963 3.440394   13.61805   319.6  -1.172814 1.323174          ?        ? 
1 1 1   26   21   14 f 12.26253 4.278846   17.44553    45.8   1.804329 1.293102          ?        ? 
1 1 1   26   22    0 o 53.46969 1.606076   57.19159   180.0   28.74897 1.714112   28.74897 1.714112 
1 1 1   26   22    1 o 24.79839 1.818998   31.37963    96.9   6.194862 0.9021643          ?        ? 
1 1 1   26   22    2 o 39.72729 1.362536   41.59469    69.9   15.84802 1.082597          ?        ? 
1 1 1   26   22    3 o 16.35046 3.241935   31.72924    59.9   2.826782 1.022453          ?        ? 
1 1 1   26   22    4 o 38.87239 1.431182   61.99113   118.1   15.18643 1.112669          ?        ? 
1 1 1   26   22    5 o 22.97911 2.224744   39.48455   197.7   5.352841 1.022453          ?        ? 
1 1 1   26   22    6 o 29.66999 1.621687   46.66385    86.1   8.871283 0.9623086          ?        ? 
1 1 1   26   22    7 o 20.33827 2.291828   28.57817   179.5   4.210100 0.9322364          ?        ? 
1 1 1   26   22    8 o 24.67634 1.827995   34.47319   279.7   6.164790 0.9021643          ?        ? 
1 1 1   26   22    9 o 8.090103 3.260143   13.01493   286.7  0.3608657 0.8119479          ?        ? 
1 1 1   26   22   10 o 8.647668 3.232148   14.81418   189.9  0.6315150 0.7518036          ?        ? 
1 1 1   26   22   11 o 12.70407 2.686583   11.31722    80.2   1.744184 0.6615872          ?        ? 
1 1 1   26   22   12 o 9.545105 3.923368   8.779744   109.9  0.5412986 1.202886          ?        ? 
1 1 1   26   22   13 o 15.36838 4.121314   18.44522   245.2   2.826782 1.293102          ?        ? 
1 1 1   26   22   14 o 10.81550 4.114634   8.644015   331.2   1.263030 1.232958          ?        ? 
1 1 1   26   23    0 o 37.80699 1.919490   56.22907    -0.0   14.46470 1.443463   14.46470 1.443463 
1 1 1   26   23    1 o 17.89688 2.436437   21.85768   100.7   3.247792 0.8720922          ?        ? 
1 1 1   26   23    2 f 28.97174 1.660771   39.97196   306.0   8.450273 0.9623086          ?        ? 
1 1 1   26   23    3 o 11.15034 3.812093   14.08512   194.8   1.202886 1.022453          ?        ? 
1 1 1   26   23    4 o 14.50814 3.376697   11.36182   174.0   2.255411 0.9623086          ?        ? 
1 1 1   26   23    5 o 32.36945 1.579349   30.53366   294.4   10.55532 1.022453          ?        ? 
1 1 1   26   23    6 o 46.48503 1.196804   39.45388   192.2   21.71209 1.112669          ?        ? 
1 1 1   26   23    7 o 12.72192 3.612777   17.80169   233.0   1.744184 0.9623086          ?        ? 
1 1 1   26   23    8 o 48.89091 1.199419   65.14317   242.7   24.05772 1.172814          ?        ? 
1 1 1   26   23    9 o 29.48063 1.632103   28.16299   201.9   8.811138 0.9623086          ?        ? 
1 1 1   26   23   10 o 16.83974 2.500099   21.88284   243.8   2.947070 0.8420200          ?        ? 
1 1 1   26   23   11 o 25.81655 1.514292   25.16499   199.3   6.766232 0.7818757          ?        ? 
1 1 1   26   23   12 o 25.07836 2.877905   41.08681   137.3   6.736160 1.443463          ?        ? 
1 1 1   26   23   13 o 16.33998 4.275696   23.72211   121.5   3.307936 1.413391          ?        ? 
1 1 1   26   23   14 f 13.62143 4.434072   16.05516   120.4   2.405771 1.383319          ?        ? 
1 1 1   26   24    0 o 8.602697 4.930489   4.330538   180.0   1.022453 1.323174   1.022453 1.323174 
1 1 1   26   24    1 o 9.384808 3.534090   24.82224    84.9  0.6916593 0.9021643          ?        ? 
1 1 1   26   24    2 o 48.21628 1.153832   55.32696   105.0   23.33598 1.112669          ?        ? 
1 1 1   26   24    3 o 15.90211 3.039802   14.39420   315.8   2.676421 0.9322364          ?        ? 
1 1 1   26   24    4 o 17.62873 2.899962   18.87062    35.9   3.187647 1.022453          ?        ? 
1 1 1   26   24    5 o 39.37257 1.413001   61.56975   135.1   15.60744 1.112669          ?        ? 
1 1 1   26   24    6 o 24.27694 2.043875   26.85852   266.9   5.984357 0.9923807          ?        ? 
1 1 1   26   24    7 o 43.77223 1.339678   57.90959   162.9   19.30632 1.172814          ?        ? 
1 1 1   26   24    8 o 12.12420 3.730042   20.06656   153.3   1.593824 0.9923807          ?        ? 
1 1 1   26   24    9 o 24.10304 2.058622   29.96949    27.0   5.954284 0.9923807          ?        ? 
1 1 1   26   24   10 o 9.816992 3.505046   19.70291    64.2  0.9322364 0.8720922          ?        ? 
1 1 1   26   24   11 o 20.91665 2.012798   23.71919    37.3   4.510822 0.8420200          ?        ? 
1 1 1   26   24   12 o 21.33521 1.620934   31.13602   281.8   4.661182 0.6916593          ?        ? 
1 1 1   26   24   13 o 18.89471 3.873518   16.39279    20.1   4.300317 1.413391          ?        ? 
1 1 1   26   25    0 f 17.76621 4.899896   10.08444   360.0   3.879307 1.503607   3.879307 1.503607 
1 1 1   26   25    1 o 12.01707 3.447848   28.27210   296.3   1.533679 0.8720922          ?        ? 
1 1 1   26   25    2 o 28.68515 1.677364   35.94987   231.5   8.299912 0.9623086          ?        ? 
1 1 1   26   25    3 o 25.63208 1.877157   34.08828   294.6   6.645944 0.9623086          ?        ? 
1 1 1   26   25    4 o 44.01180 1.298222   59.41930   312.5   19.48675 1.142741          ?        ? 
1 1 1   26   25    5 o 14.21049 3.593380   26.72717   138.4   2.195267 1.022453          ?        ? 
1 1 1   26   25    6 o 41.08771 1.390612   47.97435   145.5   17.02083 1.142741          ?        ? 
1 1 1   26   25    7 o 8.714104 3.500870   3.706118   162.8  0.4510822 0.9322364          ?        ? 
1 1 1   26   25    8 o 21.05994 2.356086   25.77787   201.1   4.570966 0.9923807          ?        ? 
1 1 1   26   25    9 o 14.07104 3.355127   13.38437   312.3   2.195267 0.9322364          ?        ? 
1 1 1   26   25   10 o 9.572512 3.548004   5.744564   336.1  0.8420200 0.9021643          ?        ? 
1 1 1   26   25   11 o 11.74940 3.472944   16.92234   352.9   1.563751 0.8720922          ?        ? 
1 1 1   26   25   12 o 19.62232 2.068939   19.86671     8.7   4.029667 0.8119479          ?        ? 
1 1 1   26   25   13 o 8.405151 3.812583   13.12476   338.7 -0.2105050 1.383319          ?        ? 
1 1 1   26   26    0 o 22.79240 2.842999   17.90042   360.0   5.503202 1.263030   5.503202 1.263030 
1 1 1   26   26    1 o 25.13747 1.973908   35.19705   236.4   6.405366 0.9923807          ?        ? 
1 1 1   26   26    2 o 54.31104 1.079719   47.59323   274.6   29.62106 1.172814          ?        ? 
1 1 1   26   26    3 o 43.01252 1.293425   49.22172   216.6   18.61466 1.112669          ?        ? 
1 1 1   26   26    4 o 21.08908 2.352831   24.31957    13.1   4.540894 0.9923807          ?        ? 
1 1 1   26   26    5 o 58.42662 1.158074   67.69389    48.3   34.34239 1.353247          ?        ? 
1 1 1   26   26    6 o 10.04010 3.765982   14.27951   262.4  0.8720922 1.022453          ?        ? 
1 1 1   26   26    7 o 9.777195 3.779928   23.67880   161.0  0.7518036 1.052525          ?        ? 
1 1 1   26   26    8 o 9.650202 3.685561   15.19195   287.3  0.7818757 0.9923807          ?        ? 
1 1 1   26   26    9 f 35.94298 1.505993   42.42841   307.9   13.11145 1.082597          ?        ? 
1 1 1   26   26   10 o 25.32457 1.959324   24.85270   318.7   6.615872 0.9923807          ?        ? 
1 1 1   26   26   11 o 13.83178 3.391376   26.01036   317.4   2.195267 0.9322364          ?        ? 
1 1 1   26   26   12 o 9.626616 3.443383   9.140779   224.3  0.9923807 0.8420200          ?        ? 
1 1 1   26   27    0 o 59.05720 1.402065   70.54720   180.0   35.06412 1.653968   35.06412 1.653968 
1 1 1   26   27    1 o 32.45824 1.667677   36.11255   146.5   10.64554 1.082597          ?        ? 
1 1 1   26   27    2 o 45.11293 1.266534   63.41364    92.8   20.47913 1.142741          ?        ? 
1 1 1   26   27    3 f 9.930964 3.834752   1.742273   239.6  0.7518036 1.082597          ?        ? 
1 1 1   26   27    4 o 31.16437 1.785162   49.09761   316.8   9.863664 1.112669          ?        ? 
1 1 1   26   27    5 o 24.32023 2.287539   22.38575   194.0   6.074574 1.112669          ?        ? 
1 1 1   26   27    6 o 20.79009 3.037577   10.91000   153.7   4.540894 1.263030          ?        ? 
1 1 1   26   27    7 o 20.66897 2.982630   18.18899   207.9   4.510822 1.232958          ?        ? 
1 1 1   26   27    8 o 25.53918 2.413856   36.56227   192.0   6.766232 1.232958          ?        ? 
1 1 1   26   27    9 o 20.75649 3.114934   23.44529   209.4   4.631110 1.293102          ?        ? 
1 1 1   26   27   10 o 27.09554 2.330698   36.64042   115.6   7.698469 1.263030          ?        ? 
1 1 1   26   27   11 o 9.195752 3.862054   12.75726   147.8  0.5112265 1.202886          ?        ? 
1 1 1   26   27   12 o 20.85063 2.235512   28.54418   119.7   4.631110 0.9322364          ?        ? 
1 1 1   26   28    0 o 37.43885 1.938770   55.97193   180.0   14.25420 1.443463   14.25420 1.443463 
1 1 1   26   28    1 f 26.06908 2.134079   45.24169   222.0   6.946666 1.112669          ?        ? 
1 1 1   26   28    2 o 23.18997 2.399032   30.33144   313.1   5.533275 1.112669          ?        ? 
1 1 1   26   28    3 o 7.484406 3.401961   20.03041   134.4 -0.5412986 1.112669          ?        ? 
1 1 1   26   28    4 o 26.81053 2.187226   38.82105    11.5   7.367675 1.172814          ?        ? 
1 1 1   26   28    5 o 31.65955 1.994706   37.44303    34.5   10.25460 1.263030          ?        ? 
1 1 1   26   28    6 o 23.04220 2.414417   24.64942   304.3   5.503202 1.112669          ?        ? 
1 1 1   26   28    7 o 22.05103 3.000256   26.20412    17.0   5.142337 1.323174          ?        ? 
1 1 1   26   28    8 o 14.74714 4.055799   19.69859    78.9   2.526060 1.232958          ?        ? 
1 1 1   26   28    9 o 26.00695 2.370440   21.88347    49.3   7.097026 1.232958          ?        ? 
1 1 1   26   28   10 o 12.19269 4.276513   10.31073    13.3   1.744184 1.293102          ?        ? 
1 1 1   26   28   11 o 15.20158 3.851264   11.95729   102.4   2.826782 1.172814          ?        ? 
1 1 1   26   29    0 o 9.617800 5.777622   2.488427   180.0   1.232958 1.954689   1.232958 1.954689 
1 1 1   26   29    1 o 28.58351 2.419784   35.83260   272.2   8.420200 1.383319          ?        ? 
1 1 1   26   29    2 o 8.974973 3.709940   15.34695    65.8  0.3608657 1.082597          ?        ? 
1 1 1   26   29    3 o 14.02072 3.699383   11.80337    65.8   2.195267 1.052525          ?        ? 
1 1 1   26   29    4 o 9.682546 3.911444   12.92370     3.0  0.6014429 1.172814          ?        ? 
1 1 1   26   29    5 o 13.48024 3.972618   21.07940     3.5   2.044906 1.142741          ?        ? 
1 1 1   26   29    6 o 16.80264 3.594529   27.81149     4.6   3.157575 1.172814          ?        ? 
1 1 1   26   29    7 o 23.65034 2.543062   18.40393   281.9   5.864068 1.202886          ?        ? 
1 1 1   26   29    8 o 27.61199 2.178195   36.93251   318.8   7.939046 1.202886          ?        ? 
1 1 1   26   29    9 o 22.26550 2.836294   25.32954   257.3   5.352841 1.263030          ?        ? 
1 1 1   26   29   10 f 13.70809 4.145761   10.62250   338.9   2.345627 1.232958          ?        ? 
1 1 1   26   30    0 o 18.07833 5.853779   23.50714   180.0   4.420605 1.864473   4.420605 1.864473 
1 1 1   26   30    1 o 28.08096 2.677272   33.64853   330.1   8.239767 1.503607          ?        ? 
1 1 1   26   30    2 o 28.78726 2.454889   34.03519   281.9   8.600634 1.413391          ?        ? 
1 1 1   26   30    3 o 9.288493 3.821990   28.73142   214.2  0.4510822 1.142741          ?        ? 
1 1 1   26   30    4 o 25.31109 2.435608   33.28213   173.4   6.645944 1.232958          ?        ? 
1 1 1   26   30    5 o 13.24461 3.855047   19.31083   244.9   1.984761 1.082597          ?        ? 
1 1 1   26   30    6 o 28.07968 2.195463   22.45696    68.8   8.179624 1.232958          ?        ? 
1 1 1   26   30    7 o 32.73906 1.928935   36.83521   353.6   11.06655 1.263030          ?        ? 
1 1 1   26   30    8 o 7.733849 3.488860   3.285550   166.3 -0.3007214 1.142741          ?        ? 
1 1 1   26   30    9 o 12.12171 4.082784   16.82680    56.2   1.774257 1.172814          ?        ? 
1 1 1   26   30   10 o 6.754606 3.241887   15.42281   281.7  -1.323174 1.263030          ?        ? 
1 1 1   26   31    0 o 28.96305 3.788909   27.12681     0.0   9.172004 2.135122   9.172004 2.135122 
1 1 1   26   31    1 o 21.00818 3.149188   28.27381   199.3   4.691255 1.323174          ?        ? 
1 1 1   26   31    2 o 33.00404 2.141239   33.43972   302.4   11.21691 1.413391          ?        ? 
1 1 1   26   31    3 o 12.14408 4.527774   3.800462   149.3   1.473535 1.473535          ?        ? 
1 1 1   26   31    4 o 30.24252 1.988733   41.94839    95.2   9.412581 1.202886          ?        ? 
1 1 1   26   31    5 o 11.20095 4.104743   6.547907   176.8   1.293102 1.202886          ?        ? 
1 1 1   26   31    6 o 18.86929 3.028046   20.53608   312.2   3.849235 1.142741          ?        ? 
1 1 1   26   31    7 o 16.84462 3.672399   19.77867    63.7   3.307936 1.202886          ?        ? 
1 1 1   26   31    8 o 6.635189 3.158062   9.084326    53.1  -1.082597 1.142741          ?        ? 
1 1 1   26   31    9 o 6.901455 3.239065   6.632938    37.0 -0.8119479 1.142741          ?        ? 
1 1 1   26   32    0 o 9.537077 5.793673   11.13157   180.0   1.263030 2.014834   1.263030 2.014834 
1 1 1   26   32    1 o 9.183319 3.982559   11.70327   103.0  0.1202886 1.353247          ?        ? 
1 1 1   26   32    2 f 24.14241 3.051757   26.32552    46.8   6.255006 1.473535          ?        ? 
1 1 1   26   32    3 o 47.80814 1.635445   49.26431   338.5   23.36606 1.563751          ?        ? 
1 1 1   26   32    4 o 11.28749 4.305862   10.78831   250.8   1.263030 1.353247          ?        ? 
1 1 1   26   32    5 o 23.16645 2.661085   21.25041   243.4   5.713707 1.232958          ?        ? 
1 1 1   26   32    6 o 11.75267 4.260861   7.872855    83.1   1.563751 1.293102          ?        ? 
1 1 1   26   32    7 o 11.80029 4.172163   11.99005   141.5   1.653968 1.232958          ?        ? 
1 1 1   26   32    8 o 32.82112 2.015736   31.69841     1.8   11.33720 1.323174          ?        ? 
1 1 1   26   33    0 o 6.219742 4.321308   8.422333   360.0 -0.9623086 1.774257 -0.9623086 1.774257 
1 1 1   26   33    1 o 13.13677 4.526810   11.04315   246.2   2.014834 1.443463          ?        ? 
1 1 1   26   33    2 o 9.198571 4.029538   10.86533   152.3       0.09 1.413391          ?        ? 
1 1 1   26   33    3 o 16.22471 4.421394   28.07878    64.2   3.217719 1.473535          ?        ? 
1 1 1   26   33    4 o 11.36275 4.240511   8.496697    59.2   1.383319 1.293102          ?        ? 
1 1 1   26   33    5 o 29.65471 2.535192   36.67792   275.8   9.442654 1.503607          ?        ? 
1 1 1   26   33    6 o 12.67303 4.186159   12.35105   230.9   1.984761 1.232958          ?        ? 
1 1 1   26   33    7 o 7.977572 3.569041   10.78490   199.2      -0.09 1.172814          ?        ? 
1 1 1   26   34    0 o 11.82152 6.249398   2.788629   180.0   2.526060 1.954689   2.526060 1.954689 
1 1 1   26   34    1 o 11.78828 4.526581   5.495597   214.9   1.503607 1.503607          ?        ? 
1 1 1   26   34    2 o 19.06366 4.284844   15.92970   336.5   4.480750 1.593824          ?        ? 
1 1 1   26   34    3 o 7.215615 3.481102   5.138472    38.7  -1.714112 1.503607          ?        ? 
1 1 1   26   34    4 f 12.08819 4.447528   5.753294    42.6   1.744184 1.413391          ?        ? 
1 1 1   26   34    5 o 11.09251 4.360210   13.18902   222.1   1.323174 1.413391          ?        ? 
1 1 1   26   35    0 o 16.25669 6.565955   11.32155   180.0   4.330389 2.074978   4.330389 2.074978 
1 1 1   26   35    1 o 8.137626 3.776504   14.33096   296.7 -0.6615872 1.473535          ?        ? 
1 1 1   26   35    2 o 7.588665 3.625296   7.153907   249.4  -1.353247 1.533679          ?        ? 
1 1 1   26   35    3 o 9.212437 4.121345   6.936190   170.9       0.06 1.563751          ?        ? 
1 1 1   27    0    1 o 67.37079 1.340286   67.72752   270.0   45.46908 1.804329   45.46908 1.804329 
1 1 1   27    0    2 o 15.68655 4.223265   6.251645    90.0   2.947070 1.142741   2.947070 1.142741 
1 1 1   27    0    3 o 36.24159 1.919844   96.84995   270.0   13.26182 1.383319   13.26182 1.383319 
1 1 1   27    0    4 o 70.86152 1.401674   105.0684    90.0   50.31070 1.984761   50.31070 1.984761 
1 1 1   27    0    5 o 49.90768 1.418536   63.11963    90.0   24.98995 1.413391   24.98995 1.413391 
1 1 1   27    0    6 o 42.42670 1.635531   77.82083    90.0   18.10343 1.383319   18.10343 1.383319 
1 1 1   27    0    7 o 49.11396 1.410844   52.60955    90.0   24.20808 1.383319   24.20808 1.383319 
1 1 1   27    0    8 o 19.17553 2.519233   26.42858    90.0   3.759018 0.9623086   3.759018 0.9623086 
1 1 1   27    0    9 o 29.19626 1.711753   49.39009    90.0   8.630706 0.9923807   8.630706 0.9923807 
1 1 1   27    0   10 o 43.32920 1.007567   71.43457    90.0   18.82516 0.8720922   18.82516 0.8720922 
1 1 1   27    0   11 o 9.705548 6.353239   13.20619   270.0       0.06 2.947070       0.06 2.947070 
1 1 1   27    0   12 o 28.73859 5.703745   32.41765   270.0   9.472726 2.916998   9.472726 2.916998 
1 1 1   27    0   13 o 19.99423 7.869386   40.35032   270.0   5.924213 3.007215   5.924213 3.007215 
1 1 1   27    0   14 x        ?      ?   21.50969    90.0          ?        ?          ?        ? 
1 1 1   27    0   15 x        ?      ?   5.764929    90.0          ?        ?          ?        ? 
1 1 1   27    0   16 o 12.66710 6.353084   15.94933    90.0   2.766637 1.954689   2.766637 1.954689 
1 1 1   27    0   17 x        ?      ?   11.87558   270.0          ?        ?          ?        ? 
1 1 1   27    1    0 o 83.86756 1.309484   91.21905   180.0   70.42896 2.195267   70.42896 2.195267 
1 1 1   27    1    1 o 39.97995 1.165880   51.01365   117.5   15.99838 0.9322364          ?        ? 
1 1 1   27    1    2 o 88.51561 0.9512674   133.6712    89.3   78.39809 1.684040          ?        ? 
1 1 1   27    1    3 o 26.27180 1.716983   42.49060   226.5   6.916593 0.9021643          ?        ? 
1 1 1   27    1    4 o 41.48754 1.195999   58.23046   196.5   17.23134 0.9923807          ?        ? 
1 1 1   27    1    5 o 18.47028 2.360799   29.38473   133.0   3.428224 0.8720922          ?        ? 
1 1 1   27    1    6 o 68.77276 0.8964000   117.1420    95.9   47.33355 1.232958          ?        ? 
1 1 1   27    1    7 o 84.80821 0.9219339   108.6554   108.3   71.99271 1.563751          ?        ? 
1 1 1   27    1    8 o 40.00698 1.089925   56.65189   144.7   16.02845 0.8720922          ?        ? 
1 1 1   27    1    9 o 9.444445 3.202801   19.95578    85.4  0.8420200 0.7217315          ?        ? 
1 1 1   27    1   10 o 57.54094 0.9145882   90.18099    79.9   33.16957 1.052525          ?        ? 
1 1 1   27    1   11 o 11.71738 3.396387   4.514755   350.3   1.443463 0.8420200          ?        ? 
1 1 1   27    1   12 o 21.95060 4.600130   34.20118   266.5   5.292697 1.954689          ?        ? 
1 1 1   27    1   13 o 25.21533 3.100795   35.04438   246.6   6.585800 1.563751          ?        ? 
1 1 1   27    1   14 o 16.87491 6.190527   20.34358   321.8   3.217719 2.736565          ?        ? 
1 1 1   27    1   15 o 24.86336 4.586895   24.69648    55.1   7.127099 2.195267          ?        ? 
1 1 1   27    1   16 o 10.75330 4.884572   14.86963    11.8 -0.3307936 2.285483          ?        ? 
1 1 1   27    1   17 o 10.27482 4.585052   15.60727   265.7  0.2105050 1.924617          ?        ? 
1 1 1   27    2    0 o 19.47350 3.363512   17.36635   180.0   4.089812 1.202886   4.089812 1.202886 
1 1 1   27    2    1 f 49.73020 1.058235   94.54323   269.3   24.74938 1.052525          ?        ? 
1 1 1   27    2    2 o 60.17766 0.9744594   86.60522   270.6   36.23693 1.172814          ?        ? 
1 1 1   27    2    3 o 95.84879 0.9569243   134.5070   114.4   91.93055 1.834401          ?        ? 
1 1 1   27    2    4 o 30.94673 1.457609   35.61876    10.6   9.593014 0.9021643          ?        ? 
1 1 1   27    2    5 o 5.981782 2.786525   14.07867   133.9 -0.7518036 0.8119479          ?        ? 
1 1 1   27    2    6 o 9.399239 3.435271   9.701183   120.1  0.7217315 0.8420200          ?        ? 
1 1 1   27    2    7 o 50.52878 1.011753   76.42719    41.6   25.56132 1.022453          ?        ? 
1 1 1   27    2    8 o 21.47011 1.960913   18.16398   340.8   4.631110 0.8420200          ?        ? 
1 1 1   27    2    9 o 20.40033 1.695216   25.67812   170.6   4.180028 0.6916593          ?        ? 
1 1 1   27    2   10 o 12.26082 3.069866   7.833090   305.2   1.593824 0.7518036          ?        ? 
1 1 1   27    2   11 o 12.70201 3.539479   23.84527    22.2   1.714112 0.9322364          ?        ? 
1 1 1   27    2   12 o 32.35294 1.347779   43.80078   104.6   10.52525 0.8720922          ?        ? 
1 1 1   27    2   13 o 20.68143 4.488174   27.39544   328.2   4.751399 1.804329          ?        ? 
1 1 1   27    2   14 o 35.60851 2.280207   57.18936   251.0   13.02124 1.623896          ?        ? 
1 1 1   27    2   15 o 19.36764 5.341898   27.59501   290.0   4.570966 2.135122          ?        ? 
1 1 1   27    2   16 o 10.34959 4.737948   16.62754   314.0 -0.6014429 2.225339          ?        ? 
1 1 1   27    2   17 o 13.67832 5.508245   25.99187    33.9   2.345627 2.315555          ?        ? 
1 1 1   27    3    0 o 30.10269 2.067681   50.89666   360.0   9.202076 1.232958   9.202076 1.232958 
1 1 1   27    3    1 o 41.78081 1.151616   50.73262   210.6   17.47192 0.9623086          ?        ? 
1 1 1   27    3    2 o 92.07461 0.9798188   159.8049    39.4   84.83352 1.804329          ?        ? 
1 1 1   27    3    3 o 26.77932 1.740590   60.00368    51.6   7.187243 0.9322364          ?        ? 
1 1 1   27    3    4 o 58.70709 0.9988689   91.60585    10.1   34.49275 1.172814          ?        ? 
1 1 1   27    3    5 f 28.14578 1.549242   53.16405    65.5   7.939046 0.8720922          ?        ? 
1 1 1   27    3    6 o 43.32906 1.075764   45.55107   317.0   18.79509 0.9322364          ?        ? 
1 1 1   27    3    7 o 19.86777 2.194741   31.69925   321.7   3.969523 0.8720922          ?        ? 
1 1 1   27    3    8 o 45.45451 1.058540   72.02687   116.3   20.68964 0.9623086          ?        ? 
1 1 1   27    3    9 o 7.150275 3.168717   15.89884   102.5 -0.3007214 0.9021643          ?        ? 
1 1 1   27    3   10 o 15.40159 2.538295   30.97686    42.9   2.405771 0.7818757          ?        ? 
1 1 1   27    3   11 o 11.71649 3.687006   18.29048    93.1   1.413391 0.9623086          ?        ? 
1 1 1   27    3   12 o 11.70038 3.476276   15.79929   218.2   1.443463 0.8720922          ?        ? 
1 1 1   27    3   13 o 45.69408 1.184614   54.28667   167.4   20.99036 1.082597          ?        ? 
1 1 1   27    3   14 o 15.46671 5.557161   31.42490    17.9   2.616277 2.195267          ?        ? 
1 1 1   27    3   15 o 20.72508 4.346923   36.74862   311.8   4.931832 1.744184          ?        ? 
1 1 1   27    3   16 o 10.89241 4.474598   16.07364   250.0  0.8720922 1.563751          ?        ? 
1 1 1   27    3   17 o 9.610826 4.224086   12.91890   186.6  0.2706493 1.563751          ?        ? 
1 1 1   27    4    0 o 7.898322 4.689282   9.233157   180.0  0.7217315 1.263030  0.7217315 1.263030 
1 1 1   27    4    1 o 12.09512 3.518738   21.55396   133.0   1.503607 0.9021643          ?        ? 
1 1 1   27    4    2 o 68.99524 0.9588883   122.6489   191.7   47.63427 1.323174          ?        ? 
1 1 1   27    4    3 o 7.017281 3.091678   10.12090     7.0 -0.2405772 0.8420200          ?        ? 
1 1 1   27    4    4 o 31.18764 1.446349   45.38846   145.4   9.743376 0.9021643          ?        ? 
1 1 1   27    4    5 o 53.33214 1.155924   95.01441     1.7   28.47832 1.232958          ?        ? 
1 1 1   27    4    6 o 57.68979 1.094674   77.27746    36.4   33.31994 1.263030          ?        ? 
1 1 1   27    4    7 o 32.81723 1.420346   48.85078   352.3   10.79590 0.9322364          ?        ? 
1 1 1   27    4    8 o 12.54696 3.308047   33.40148   150.2   1.653968 0.8420200          ?        ? 
1 1 1   27    4    9 o 45.76052 1.248611   65.17413   326.7   20.99036 1.142741          ?        ? 
1 1 1   27    4   10 o 16.87481 2.494902   1.439541    89.9   2.886926 0.8420200          ?        ? 
1 1 1   27    4   11 o 36.38481 1.239754   48.88037   182.0   13.29189 0.9021643          ?        ? 
1 1 1   27    4   12 o 19.13158 2.436382   26.13006    29.3   3.728946 0.9322364          ?        ? 
1 1 1   27    4   13 o 14.36485 3.220251   20.05276   276.3   2.225339 0.9021643          ?        ? 
1 1 1   27    4   14 o 26.09659 1.728510   31.55078   241.1   6.916593 0.9021643          ?        ? 
1 1 1   27    4   15 o 29.27515 3.749369   35.28375    27.2   9.322365 2.195267          ?        ? 
1 1 1   27    4   16 o 29.04524 2.847227   31.76260    13.6   9.021644 1.653968          ?        ? 
1 1 1   27    4   17 o 9.946057 4.601178   4.579639   253.8 -0.4811543 2.165194          ?        ? 
1 1 1   27    5    0 o 41.01676 1.729587   75.74171   180.0   16.93062 1.413391   16.93062 1.413391 
1 1 1   27    5    1 o 14.91984 2.926122   16.88230    32.8   2.315555 0.8420200          ?        ? 
1 1 1   27    5    2 o 68.14038 0.9488516   90.37092   279.7   46.46146 1.293102          ?        ? 
1 1 1   27    5    3 o 86.32143 1.062541   146.5919    35.7   74.57892 1.834401          ?        ? 
1 1 1   27    5    4 o 50.88522 1.152411   58.02175     3.5   25.92219 1.172814          ?        ? 
1 1 1   27    5    5 o 6.989331 3.152184   40.45963   273.4 -0.4811543 0.9322364          ?        ? 
1 1 1   27    5    6 o 39.77513 1.323094   46.55814   131.6   15.84802 1.052525          ?        ? 
1 1 1   27    5    7 o 52.27186 1.121840   85.33356   148.2   27.36565 1.172814          ?        ? 
1 1 1   27    5    8 o 39.69927 1.136248   45.10493    43.2   15.78788 0.9021643          ?        ? 
1 1 1   27    5    9 o 42.05404 1.430167   50.95514    74.7   17.74257 1.202886          ?        ? 
1 1 1   27    5   10 o 5.936139 2.816166   4.501164    21.9  -1.082597 0.9021643          ?        ? 
1 1 1   27    5   11 o 17.63390 2.387504   18.18596   246.0   3.157575 0.8420200          ?        ? 
1 1 1   27    5   12 o 10.54153 3.689967   25.55602   228.4   1.052525 0.9623086          ?        ? 
1 1 1   27    5   13 o 35.05414 1.629966   52.75575   139.2   12.41980 1.142741          ?        ? 
1 1 1   27    5   14 o 20.38423 2.286662   20.74274   254.3   4.270245 0.9322364          ?        ? 
1 1 1   27    5   15 o 15.96509 3.220872   21.20671   147.5   2.796710 0.9923807          ?        ? 
1 1 1   27    5   16 o 12.75110 2.895470   15.16194    21.8   1.804329 0.7217315          ?        ? 
1 1 1   27    5   17 o 9.275248 4.372715   20.13293    13.2  -1.142741 2.135122          ?        ? 
1 1 1   27    6    0 o 15.31129 4.208171   24.76694     0.0   2.826782 1.112669   2.826782 1.112669 
1 1 1   27    6    1 o 38.32557 1.255440   68.59330   248.3   14.70528 0.9623086          ?        ? 
1 1 1   27    6    2 o 41.62880 1.300299   64.96005   263.9   17.35163 1.082597          ?        ? 
1 1 1   27    6    3 o 109.1008 1.102546   155.6201   288.5   119.1458 2.405771          ?        ? 
1 1 1   27    6    4 o 22.69797 2.119812   58.17638   258.6   5.172409 0.9623086          ?        ? 
1 1 1   27    6    5 o 43.24953 1.286337   71.25478    54.7   18.73495 1.112669          ?        ? 
1 1 1   27    6    6 o 25.78872 1.924060   54.30607   258.9   6.676016 0.9923807          ?        ? 
1 1 1   27    6    7 o 43.14688 1.115155   75.76035   194.3   18.64473 0.9623086          ?        ? 
1 1 1   27    6    8 o 24.29033 1.671340   34.43205   261.0   5.924213 0.8119479          ?        ? 
1 1 1   27    6    9 f 22.03986 2.319554   34.29371   149.2   4.901759 1.022453          ?        ? 
1 1 1   27    6   10 o 24.58891 2.079094   35.76191   133.3   6.104645 1.022453          ?        ? 
1 1 1   27    6   11 o 15.29829 3.243795   28.44129   214.2   2.495988 0.9623086          ?        ? 
1 1 1   27    6   12 o 14.12525 3.913127   11.23971   306.9   2.165194 1.142741          ?        ? 
1 1 1   27    6   13 o 25.31148 2.079146   35.10748    15.7   6.525656 1.052525          ?        ? 
1 1 1   27    6   14 o 18.85706 2.711061   31.57540   115.7   3.698874 1.022453          ?        ? 
1 1 1   27    6   15 o 16.62948 3.626812   28.07520   173.9   3.097431 1.172814          ?        ? 
1 1 1   27    6   16 o 8.359216 3.743491   8.522619   149.3 -0.2405772 1.293102          ?        ? 
1 1 1   27    6   17 f 12.18656 3.657972   14.01401   283.6   1.774257 0.9623086          ?        ? 
1 1 1   27    7    0 o 7.042989 4.375676   16.63263     0.0  0.3909379 1.202886  0.3909379 1.202886 
1 1 1   27    7    1 f 52.51289 1.202591   80.76032   119.2   27.60623 1.263030          ?        ? 
1 1 1   27    7    2 o 48.39929 1.304802   64.14925     6.6   23.45627 1.263030          ?        ? 
1 1 1   27    7    3 o 21.74730 2.350759   6.684802   164.0   4.751399 1.022453          ?        ? 
1 1 1   27    7    4 o 54.47268 1.186927   68.35980   305.4   29.71128 1.293102          ?        ? 
1 1 1   27    7    5 o 48.27635 1.152396   57.90702   116.3   23.33598 1.112669          ?        ? 
1 1 1   27    7    6 o 46.17013 1.204967   64.37766   104.0   21.35122 1.112669          ?        ? 
1 1 1   27    7    7 o 27.91237 1.723803   48.88511   309.0   7.818758 0.9623086          ?        ? 
1 1 1   27    7    8 o 27.87816 1.186569   40.56637   298.4   7.788685 0.6615872          ?        ? 
1 1 1   27    7    9 o 33.98479 1.637011   37.19330   346.6   11.60785 1.112669          ?        ? 
1 1 1   27    7   10 o 27.62597 1.959383   26.56376    23.0   7.698469 1.082597          ?        ? 
1 1 1   27    7   11 o 27.65782 1.902762   34.98882    74.0   7.728541 1.052525          ?        ? 
1 1 1   27    7   12 o 17.55273 2.655531   18.14195   290.5   3.157575 0.9322364          ?        ? 
1 1 1   27    7   13 o 18.68109 3.509686   22.92676   339.6   3.789090 1.263030          ?        ? 
1 1 1   27    7   14 o 31.63616 2.186294   41.06018   125.2   10.28467 1.383319          ?        ? 
1 1 1   27    7   15 o 16.69395 3.449929   17.24365   164.6   3.097431 1.112669          ?        ? 
1 1 1   27    7   16 o 17.35232 4.127194   30.63526   153.4   3.578585 1.413391          ?        ? 
1 1 1   27    7   17 o 12.38081 3.912907   22.72376   150.1   1.864473 1.082597          ?        ? 
1 1 1   27    8    0 f 22.39477 3.179874   18.79072   360.0   5.202481 1.383319   5.202481 1.383319 
1 1 1   27    8    1 o 89.10523 1.147467   119.9469   289.2   79.48067 2.044906          ?        ? 
1 1 1   27    8    2 f 27.59110 2.016356   50.99899   235.5   7.638325 1.112669          ?        ? 
1 1 1   27    8    3 o 17.71165 2.716598   20.89135   308.5   3.157575 0.9623086          ?        ? 
1 1 1   27    8    4 o 39.81024 1.397466   53.66540    79.5   15.87809 1.112669          ?        ? 
1 1 1   27    8    5 o 50.48961 1.250782   64.46423   332.0   25.53125 1.263030          ?        ? 
1 1 1   27    8    6 o 51.45002 1.285883   84.38712   134.7   26.52363 1.323174          ?        ? 
1 1 1   27    8    7 f 56.65329 1.141242   89.46967   226.4   32.14712 1.293102          ?        ? 
1 1 1   27    8    8 o 56.65425 1.008522   81.50302   197.8   32.14712 1.142741          ?        ? 
1 1 1   27    8    9 o 73.42485 1.290125   114.7450   258.2   54.09978 1.894545          ?        ? 
1 1 1   27    8   10 o 12.91967 3.944553   16.94929   147.2   1.744184 1.112669          ?        ? 
1 1 1   27    8   11 o 46.67715 1.288517   65.09261    72.0   21.89252 1.202886          ?        ? 
1 1 1   27    8   12 o 16.08049 3.199224   25.94131    41.1   2.766637 0.9923807          ?        ? 
1 1 1   27    8   13 f 28.99285 2.333759   34.89590    20.8   8.630706 1.353247          ?        ? 
1 1 1   27    8   14 o 40.27843 1.866516   41.77209    26.3   16.56975 1.503607          ?        ? 
1 1 1   27    8   15 o 12.83552 4.473949   24.36796    70.4   1.804329 1.413391          ?        ? 
1 1 1   27    8   16 f 14.74698 4.434512   22.68162   223.4   2.646349 1.413391          ?        ? 
1 1 1   27    8   17 f 11.64797 4.613769   15.81678   343.7   1.503607 1.593824          ?        ? 
1 1 1   27    9    0 o 30.64919 2.433939   29.58447   180.0   9.593014 1.473535   9.593014 1.473535 
1 1 1   27    9    1 o 98.98437 1.184847   159.1062    42.2   98.09534 2.345627          ?        ? 
1 1 1   27    9    2 o 50.04329 1.291984   64.90187   193.0   25.08017 1.293102          ?        ? 
1 1 1   27    9    3 o 16.99938 3.124164   24.72214    39.6   3.007215 1.022453          ?        ? 
1 1 1   27    9    4 o 49.21788 1.374751   66.93656   178.7   24.26822 1.353247          ?        ? 
1 1 1   27    9    5 o 28.28447 1.860606   44.15073   194.4   8.029263 1.052525          ?        ? 
1 1 1   27    9    6 o 51.41983 1.286638   86.15656   166.9   26.49356 1.323174          ?        ? 
1 1 1   27    9    7 o 59.53044 0.9850537   89.16986    99.8   35.48513 1.172814          ?        ? 
1 1 1   27    9    8 o 48.57866 1.021416   56.55274   183.1   23.63671 0.9923807          ?        ? 
1 1 1   27    9    9 o 11.26518 3.965397   11.24452   334.6   1.172814 1.112669          ?        ? 
1 1 1   27    9   10 f 31.84231 1.841596   39.45414    26.9   10.22453 1.172814          ?        ? 
1 1 1   27    9   11 o 53.61922 1.317989   89.32898   238.5   28.89933 1.413391          ?        ? 
1 1 1   27    9   12 o 8.532008 3.599320   14.31068   279.7  0.1503607 1.052525          ?        ? 
1 1 1   27    9   13 o 22.13238 3.125102   37.06995    97.4   5.142337 1.383319          ?        ? 
1 1 1   27    9   14 o 21.73631 3.320395   41.21653    88.8   5.052120 1.443463          ?        ? 
1 1 1   27    9   15 o 12.04031 4.402871   20.59600   116.3   1.503607 1.383319          ?        ? 
1 1 1   27    9   16 o 11.01159 4.410742   9.445154   304.1   1.082597 1.473535          ?        ? 
1 1 1   27    9   17 o 11.67290 4.448769   15.75950   315.6   1.593824 1.443463          ?        ? 
1 1 1   27   10    0 o 112.6184 1.816841   150.8774     0.0   127.1150 4.089812   127.1150 4.089812 
1 1 1   27   10    1 o 87.41372 1.152470   110.8790   158.6   76.50353 2.014834          ?        ? 
1 1 1   27   10    2 o 63.29214 1.235344   110.4363   109.7   40.11624 1.563751          ?        ? 
1 1 1   27   10    3 o 27.53741 1.856480   39.18516    70.8   7.608253 1.022453          ?        ? 
1 1 1   27   10    4 o 38.85527 1.393115   54.63483   147.0   15.12629 1.082597          ?        ? 
1 1 1   27   10    5 o 27.74507 1.842585   38.85056   124.6   7.728541 1.022453          ?        ? 
1 1 1   27   10    6 o 54.40469 1.216048   94.23262   242.2   29.65113 1.323174          ?        ? 
1 1 1   27   10    7 o 34.85756 1.250937   56.04351   244.8   12.17922 0.8720922          ?        ? 
1 1 1   27   10    8 o 40.87611 1.213888   67.36793   207.2   16.75019 0.9923807          ?        ? 
1 1 1   27   10    9 o 25.68923 2.282695   36.33120   317.1   6.676016 1.172814          ?        ? 
1 1 1   27   10   10 o 40.92458 1.653342   69.54758   128.8   16.87047 1.353247          ?        ? 
1 1 1   27   10   11 o 14.88588 3.894680   20.09154   168.8   2.405771 1.172814          ?        ? 
1 1 1   27   10   12 o 19.32102 2.879428   22.22447    58.6   3.849235 1.112669          ?        ? 
1 1 1   27   10   13 o 11.11059 4.362465   22.14926   359.3  0.9623086 1.413391          ?        ? 
1 1 1   27   10   14 o 23.62961 2.990719   33.30173   299.7   5.894140 1.413391          ?        ? 
1 1 1   27   10   15 o 19.57215 3.669398   18.13279   342.0   4.330389 1.383319          ?        ? 
1 1 1   27   10   16 o 13.17329 4.528024   16.56487   136.7   2.105050 1.443463          ?        ? 
1 1 1   27   10   17 x        ?      ?   28.99260    88.1          ?        ?          ?        ? 
1 1 1   27   11    0 o 61.36180 1.570534   105.3104     0.0   37.77061 1.924617   37.77061 1.924617 
1 1 1   27   11    1 o 79.88421 1.204629   131.4432   118.2   63.90331 1.924617          ?        ? 
1 1 1   27   11    2 o 40.51494 1.484497   48.09621   224.3   16.44946 1.202886          ?        ? 
1 1 1   27   11    3 o 18.61648 2.584561   18.04283   287.6   3.488369 0.9623086          ?        ? 
1 1 1   27   11    4 o 10.25273 3.679755   15.86645    89.7  0.9021643 0.9623086          ?        ? 
1 1 1   27   11    5 o 8.131612 3.436552   9.345170   247.0       0.06 0.9623086          ?        ? 
1 1 1   27   11    6 o 7.934011 3.235903   17.25387    34.4  0.2405772 0.8119479          ?        ? 
1 1 1   27   11    7 o 34.81377 1.252510   47.71497    95.9   12.14915 0.8720922          ?        ? 
1 1 1   27   11    8 o 39.97396 1.241284   46.56252   357.2   16.02845 0.9923807          ?        ? 
1 1 1   27   11    9 o 23.41189 2.568963   35.95386    38.4   5.563347 1.202886          ?        ? 
1 1 1   27   11   10 o 26.20961 2.352110   28.42780   310.1   6.976738 1.232958          ?        ? 
1 1 1   27   11   11 o 13.75081 3.878330   16.14117   308.2   2.044906 1.112669          ?        ? 
1 1 1   27   11   12 o 32.83849 1.923094   42.92339   276.6   10.94626 1.263030          ?        ? 
1 1 1   27   11   13 o 18.96502 2.933478   31.57047   274.0   3.759018 1.112669          ?        ? 
1 1 1   27   11   14 o 10.59260 4.316434   14.92867   265.4  0.7217315 1.443463          ?        ? 
1 1 1   27   11   15 f 23.96749 3.262235   31.54896    78.5   6.255006 1.563751          ?        ? 
1 1 1   27   11   16 o 22.94647 3.341863   32.77831   118.9   5.924213 1.533679          ?        ? 
1 1 1   27   12    0 o 34.62271 2.322983   66.18534     0.0   12.17922 1.593824   12.17922 1.593824 
1 1 1   27   12    1 o 61.85233 1.215482   104.6774    97.4   38.31191 1.503607          ?        ? 
1 1 1   27   12    2 o 20.67860 2.399535   22.99845    12.4   4.300317 0.9923807          ?        ? 
1 1 1   27   12    3 o 31.50284 1.670524   45.85108    40.2   9.953879 1.052525          ?        ? 
1 1 1   27   12    4 o 11.17111 3.812094   29.70986   235.8   1.172814 1.022453          ?        ? 
1 1 1   27   12    5 o 29.01544 1.761912   74.13009   178.1   8.450273 1.022453          ?        ? 
1 1 1   27   12    6 o 18.69250 2.171854   20.96144   313.1   3.518441 0.8119479          ?        ? 
1 1 1   27   12    7 o 9.890157 3.333579   13.32114   209.7  0.9322364 0.7818757          ?        ? 
1 1 1   27   12    8 o 25.78699 1.341102   34.97311   234.4   6.676016 0.6916593          ?        ? 
1 1 1   27   12    9 o 30.71991 2.055719   56.75946   185.8   9.532870 1.263030          ?        ? 
1 1 1   27   12   10 o 31.98278 1.974547   55.19416   245.5   10.34482 1.263030          ?        ? 
1 1 1   27   12   11 o 12.62040 4.134796   19.14628   323.0   1.653968 1.202886          ?        ? 
1 1 1   27   12   12 o 18.11699 3.362779   27.33554   326.4   3.548513 1.172814          ?        ? 
1 1 1   27   12   13 o 19.35619 3.029557   22.37426    90.9   3.939451 1.172814          ?        ? 
1 1 1   27   12   14 o 7.861725 3.621631   4.452828   216.5 -0.7818757 1.323174          ?        ? 
1 1 1   27   12   15 o 9.509675 4.140404   12.58361   275.9  0.1804329 1.473535          ?        ? 
1 1 1   27   12   16 o 17.92310 4.459020   26.81418   262.5   4.089812 1.593824          ?        ? 
1 1 1   27   13    0 o 16.96802 4.813291   37.90199   180.0   3.518441 1.413391   3.518441 1.413391 
1 1 1   27   13    1 o 53.26408 1.270318   69.47116   277.2   28.41818 1.353247          ?        ? 
1 1 1   27   13    2 o 81.45572 1.218307   118.2088   314.5   66.45944 1.984761          ?        ? 
1 1 1   27   13    3 o 31.59177 1.665821   49.23701   230.6   10.01402 1.052525          ?        ? 
1 1 1   27   13    4 o 13.92809 3.551031   17.74241   117.0   2.044906 0.9923807          ?        ? 
1 1 1   27   13    5 o 13.94048 3.101190   20.48526   174.9   2.044906 0.8420200          ?        ? 
1 1 1   27   13    6 o 6.968895 3.053460   11.76133   312.1 -0.1804329 0.8119479          ?        ? 
1 1 1   27   13    7 o 23.19949 1.749926   18.10136   338.3   5.412986 0.8119479          ?        ? 
1 1 1   27   13    8 o 5.296684 2.482051   5.251513    73.9 -0.6615872 0.6615872          ?        ? 
1 1 1   27   13    9 o 31.42198 2.057640   27.55137   105.8   9.983953 1.293102          ?        ? 
1 1 1   27   13   10 o 19.18009 3.135768   21.54293   317.6   3.789090 1.202886          ?        ? 
1 1 1   27   13   11 o 9.460791 3.910682   17.75987    61.8  0.3608657 1.202886          ?        ? 
1 1 1   27   13   12 o 12.36053 4.082781   26.02012   351.8   1.623896 1.172814          ?        ? 
1 1 1   27   13   13 o 30.50330 2.119610   39.43522    13.5   9.562942 1.293102          ?        ? 
1 1 1   27   13   14 o 16.82121 4.349087   17.37185   340.7   3.307936 1.473535          ?        ? 
1 1 1   27   13   15 o 13.09631 4.385609   13.84799   144.5   2.014834 1.353247          ?        ? 
1 1 1   27   13   16 o 24.23305 3.102390   21.66263    25.8   6.555727 1.503607          ?        ? 
1 1 1   27   14    0 o 40.53058 2.089254   57.29307     0.0   16.59982 1.684040   16.59982 1.684040 
1 1 1   27   14    1 o 10.08450 3.850019   4.913005    30.8  0.7217315 1.082597          ?        ? 
1 1 1   27   14    2 o 15.00987 3.472253   3.934255   167.0   2.375700 1.022453          ?        ? 
1 1 1   27   14    3 o 49.42976 1.247182   72.55281   213.5   24.47873 1.232958          ?        ? 
1 1 1   27   14    4 o 18.51222 2.680339   15.21674    53.5   3.458297 0.9923807          ?        ? 
1 1 1   27   14    5 o 12.30440 3.250434   28.56690    13.0   1.593824 0.8119479          ?        ? 
1 1 1   27   14    6 f 21.66364 1.943394   48.37106    44.0   4.721327 0.8420200          ?        ? 
1 1 1   27   14    7 o 21.99623 1.777295   28.27437    60.8   4.871688 0.7818757          ?        ? 
1 1 1   27   14    8 o 25.24399 1.489074   36.29287    88.2   6.405366 0.7518036          ?        ? 
1 1 1   27   14    9 o 14.02806 4.124036   12.92395   348.7   2.105050 1.232958          ?        ? 
1 1 1   27   14   10 o 9.575777 3.894564   20.93644    17.6  0.4510822 1.172814          ?        ? 
1 1 1   27   14   11 o 11.47775 4.068018   15.26228    60.8   1.263030 1.172814          ?        ? 
1 1 1   27   14   12 o 10.82262 4.038558   10.81638   339.1   1.052525 1.172814          ?        ? 
1 1 1   27   14   13 o 9.739697 3.891276   23.15956   294.1  0.6615872 1.142741          ?        ? 
1 1 1   27   14   14 o 19.33664 3.789809   30.96999    11.8   4.240172 1.413391          ?        ? 
1 1 1   27   14   15 o 16.40391 4.198640   22.24262    39.5   3.247792 1.383319          ?        ? 
1 1 1   27   14   16 o 7.515427 3.563884   10.64703   319.9  -1.142741 1.443463          ?        ? 
1 1 1   27   15    0 o 39.62935 2.099235   73.05849     0.0   15.87809 1.653968   15.87809 1.653968 
1 1 1   27   15    1 o 62.68681 1.199301   97.77032   127.4   39.36444 1.503607          ?        ? 
1 1 1   27   15    2 o 75.19158 1.139830   114.1543    99.6   56.62585 1.714112          ?        ? 
1 1 1   27   15    3 o 24.02125 2.128226   51.70806    82.1   5.803924 1.022453          ?        ? 
1 1 1   27   15    4 o 45.13827 1.199201   71.98045   325.6   20.41899 1.082597          ?        ? 
1 1 1   27   15    5 o 18.92996 2.144611   31.62756   114.7   3.608657 0.8119479          ?        ? 
1 1 1   27   15    6 o 31.09712 1.498911   45.14428   289.9   9.713303 0.9322364          ?        ? 
1 1 1   27   15    7 o 8.788466 3.293898   18.48735   184.0  0.6014429 0.7818757          ?        ? 
1 1 1   27   15    8 f 32.88439 1.234549   50.42644   289.4   10.85604 0.8119479          ?        ? 
1 1 1   27   15    9 o 41.27509 1.639302   43.79325   225.9   17.17119 1.353247          ?        ? 
1 1 1   27   15   10 o 13.41210 4.164037   8.948077   335.4   1.924617 1.232958          ?        ? 
1 1 1   27   15   11 f 28.30686 2.337197   30.72940   314.0   8.209695 1.323174          ?        ? 
1 1 1   27   15   12 o 10.38005 3.920515   21.80807   219.2  0.9322364 1.112669          ?        ? 
1 1 1   27   15   13 o 43.63720 1.653936   56.10172   181.0   19.36646 1.443463          ?        ? 
1 1 1   27   15   14 o 6.262490 3.031313   15.98726   237.2  -1.684040 1.172814          ?        ? 
1 1 1   27   15   15 o 20.00416 3.669712   32.03978   286.8   4.661182 1.413391          ?        ? 
1 1 1   27   15   16 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   27   16    0 o 64.60352 1.654888   103.6439   180.0   41.89050 2.135122   41.89050 2.135122 
1 1 1   27   16    1 o 49.57556 1.273844   85.66365   353.8   24.62909 1.263030          ?        ? 
1 1 1   27   16    2 o 25.99945 1.966298   37.48403   240.2   6.796305 1.022453          ?        ? 
1 1 1   27   16    3 o 48.09098 1.281901   66.47913   141.2   23.18562 1.232958          ?        ? 
1 1 1   27   16    4 o 42.06877 1.286699   58.37152   136.6   17.74257 1.082597          ?        ? 
1 1 1   27   16    5 o 22.53380 1.935076   36.53212    47.7   5.112265 0.8720922          ?        ? 
1 1 1   27   16    6 o 22.25461 1.891788   32.17270    89.3   4.991976 0.8420200          ?        ? 
1 1 1   27   16    7 o 49.37622 1.096274   49.77741     5.4   24.44865 1.082597          ?        ? 
1 1 1   27   16    8 o 27.00834 1.447471   34.51214   172.7   7.337603 0.7818757          ?        ? 
1 1 1   27   16    9 o 20.79284 3.037175   30.06176   210.2   4.450677 1.263030          ?        ? 
1 1 1   27   16   10 f 18.56292 3.450061   28.19859   218.0   3.698874 1.232958          ?        ? 
1 1 1   27   16   11 o 9.367430 3.946873   12.98543   273.8  0.2706493 1.263030          ?        ? 
1 1 1   27   16   12 o 19.57066 3.150016   25.06269    92.8   4.059740 1.232958          ?        ? 
1 1 1   27   16   13 o 28.85366 2.240794   38.98917    38.5   8.600634 1.293102          ?        ? 
1 1 1   27   16   14 o 14.96316 4.029610   13.98563   261.1   2.646349 1.232958          ?        ? 
1 1 1   27   16   15 o 10.93627 4.340696   11.68668   117.1   1.202886 1.413391          ?        ? 
1 1 1   27   17    0 o 12.36320 5.743767   36.06963   180.0   2.285483 1.563751   2.285483 1.563751 
1 1 1   27   17    1 o 32.22958 1.726162   61.98268   286.0   10.43503 1.112669          ?        ? 
1 1 1   27   17    2 o 31.14619 1.689653   40.05485   102.7   9.743376 1.052525          ?        ? 
1 1 1   27   17    3 o 24.63535 1.953105   31.36506    20.5   6.104645 0.9623086          ?        ? 
1 1 1   27   17    4 o 13.15964 3.313269   14.98174   304.9   1.834401 0.8720922          ?        ? 
1 1 1   27   17    5 o 42.86428 1.227741   54.93329   296.3   18.43423 1.052525          ?        ? 
1 1 1   27   17    6 o 39.54979 1.254597   47.66607   269.8   15.69766 0.9923807          ?        ? 
1 1 1   27   17    7 o 24.18814 1.678401   29.47205   132.3   5.894140 0.8119479          ?        ? 
1 1 1   27   17    8 o 32.54157 1.339967   45.50992   176.9   10.64554 0.8720922          ?        ? 
1 1 1   27   17    9 o 21.49123 1.609167   26.52602   300.6   4.661182 0.6916593          ?        ? 
1 1 1   27   17   10 f 49.02558 1.533493   67.90598   250.7   24.26822 1.503607          ?        ? 
1 1 1   27   17   11 o 16.72529 3.928303   27.30180    55.3   3.127503 1.293102          ?        ? 
1 1 1   27   17   12 o 19.39568 3.178434   26.17090   318.4   3.999595 1.232958          ?        ? 
1 1 1   27   17   13 o 10.14996 4.076086   13.80806    22.1  0.7518036 1.263030          ?        ? 
1 1 1   27   17   14 o 10.19177 4.017263   13.82473   346.8  0.9021643 1.202886          ?        ? 
1 1 1   27   17   15 o 12.55183 4.737620   5.290706   103.3   1.924617 1.623896          ?        ? 
1 1 1   27   18    0 o 6.429004 4.383089   30.81987   360.0 -0.7518036 1.653968 -0.7518036 1.653968 
1 1 1   27   18    1 o 49.53151 1.305333   91.49400    37.9   24.59902 1.293102          ?        ? 
1 1 1   27   18    2 o 10.66717 3.520650   16.77807    95.2   1.112669 0.8720922          ?        ? 
1 1 1   27   18    3 o 47.10645 1.212935   62.08145   343.8   22.25339 1.142741          ?        ? 
1 1 1   27   18    4 o 8.921413 3.489099   16.80634   243.8  0.5112265 0.9021643          ?        ? 
1 1 1   27   18    5 o 27.82054 1.675446   23.12597   231.1   7.788685 0.9322364          ?        ? 
1 1 1   27   18    6 o 10.36213 3.459414   14.23674   227.5   1.052525 0.8420200          ?        ? 
1 1 1   27   18    7 o 8.502691 3.313176   17.82534    91.7  0.4811543 0.8119479          ?        ? 
1 1 1   27   18    8 o 11.27780 3.103680   13.28994     2.7   1.353247 0.7217315          ?        ? 
1 1 1   27   18    9 o 25.09406 1.438053   35.15403   227.8   6.345222 0.7217315          ?        ? 
1 1 1   27   18   10 o 11.12836 4.102146   20.68948   245.9   1.142741 1.202886          ?        ? 
1 1 1   27   18   11 o 27.66448 2.445819   36.58642   250.7   7.908974 1.353247          ?        ? 
1 1 1   27   18   12 o 9.389419 3.951061   9.741901   186.1  0.3307936 1.263030          ?        ? 
1 1 1   27   18   13 o 8.688653 3.785157   11.47391   313.7       0.06 1.232958          ?        ? 
1 1 1   27   18   14 o 13.11268 4.336607   19.91140   122.6   2.074978 1.323174          ?        ? 
1 1 1   27   18   15 o 28.22105 2.930380   35.78819    18.9   8.841210 1.653968          ?        ? 
1 1 1   27   19    0 o 38.71450 2.547011   42.72387   360.0   15.27665 1.954689   15.27665 1.954689 
1 1 1   27   19    1 o 14.25188 3.670998   29.10407   328.7   2.165194 1.052525          ?        ? 
1 1 1   27   19    2 o 32.86300 1.555629   56.32997    59.0   10.85604 1.022453          ?        ? 
1 1 1   27   19    3 o 32.81450 1.557929   19.61183   274.4   10.82597 1.022453          ?        ? 
1 1 1   27   19    4 o 7.066818 3.146734   18.15950    15.5 -0.3307936 0.9021643          ?        ? 
1 1 1   27   19    5 o 28.23560 1.704070   27.39498   236.0   8.029263 0.9623086          ?        ? 
1 1 1   27   19    6 o 39.76539 1.209983   57.69447   154.7   15.87809 0.9623086          ?        ? 
1 1 1   27   19    7 o 19.70150 2.213263   31.87799   226.6   3.939451 0.8720922          ?        ? 
1 1 1   27   19    8 o 40.81812 1.215613   44.50624   149.4   16.75019 0.9923807          ?        ? 
1 1 1   27   19    9 o 27.35860 1.428939   42.12003   133.7   7.548109 0.7818757          ?        ? 
1 1 1   27   19   10 o 25.59302 2.526279   35.99999   272.9   6.766232 1.293102          ?        ? 
1 1 1   27   19   11 o 10.18341 4.138368   21.32127   155.5  0.6615872 1.323174          ?        ? 
1 1 1   27   19   12 o 9.522968 3.976081   12.45971   252.5  0.4210100 1.263030          ?        ? 
1 1 1   27   19   13 o 8.092310 3.658292   14.19475   273.9 -0.3608657 1.263030          ?        ? 
1 1 1   27   19   14 o 10.38196 3.957866   12.43301   180.4   1.112669 1.142741          ?        ? 
1 1 1   27   20    0 o 50.71852 1.843375   60.67650   180.0   25.92219 1.864473   25.92219 1.864473 
1 1 1   27   20    1 f 52.03322 1.155883   71.66905    72.6   27.15515 1.202886          ?        ? 
1 1 1   27   20    2 o 18.53769 2.595546   31.06130    98.1   3.488369 0.9623086          ?        ? 
1 1 1   27   20    3 o 47.53442 1.233647   68.45341   148.7   22.67440 1.172814          ?        ? 
1 1 1   27   20    4 o 30.13363 1.646633   25.66048   192.1   9.141932 0.9923807          ?        ? 
1 1 1   27   20    5 o 14.61069 3.361050   32.89828   135.8   2.285483 0.9623086          ?        ? 
1 1 1   27   20    6 o 25.37515 1.718398   35.92197   120.5   6.495584 0.8720922          ?        ? 
1 1 1   27   20    7 o 32.50486 1.480253   41.71139    95.3   10.64554 0.9623086          ?        ? 
1 1 1   27   20    8 o 31.98970 1.457088   41.48084   355.6   10.31474 0.9322364          ?        ? 
1 1 1   27   20    9 o 27.55431 1.418790   37.29875   146.8   7.668397 0.7818757          ?        ? 
1 1 1   27   20   10 o 15.43001 2.046386   12.94594    59.9   2.435844 0.6315150          ?        ? 
1 1 1   27   20   11 o 26.99139 2.673932   40.98793    39.3   7.608253 1.443463          ?        ? 
1 1 1   27   20   12 o 26.43344 2.445960   39.42118   259.9   7.307531 1.293102          ?        ? 
1 1 1   27   20   13 o 23.90881 2.704238   29.12458   314.9   6.104645 1.293102          ?        ? 
1 1 1   27   20   14 o 27.01318 2.560451   28.00063   332.1   7.878902 1.383319          ?        ? 
1 1 1   27   21    0 o 46.18584 1.599423   73.07025     0.0   21.47151 1.473535   21.47151 1.473535 
1 1 1   27   21    1 o 12.66554 3.764251   9.871567   304.4   1.684040 1.022453          ?        ? 
1 1 1   27   21    2 o 25.87306 2.092132   34.25469   284.5   6.766232 1.082597          ?        ? 
1 1 1   27   21    3 o 31.78525 1.513766   42.99417    98.7   10.16438 0.9623086          ?        ? 
1 1 1   27   21    4 o 10.23949 3.627095   32.82376    66.8  0.9623086 0.9322364          ?        ? 
1 1 1   27   21    5 o 6.019616 2.859057   11.30801   109.6  -1.112669 0.9322364          ?        ? 
1 1 1   27   21    6 o 51.09537 1.147671   73.58170   341.3   26.22291 1.172814          ?        ? 
1 1 1   27   21    7 o 53.04190 1.133901   64.12221   310.9   28.26782 1.202886          ?        ? 
1 1 1   27   21    8 o 14.89383 2.931159   25.36846     6.7   2.375700 0.8420200          ?        ? 
1 1 1   27   21    9 f 5.255038 2.517079   4.840705   337.9 -0.9923807 0.7518036          ?        ? 
1 1 1   27   21   10 o 11.60324 2.968292   23.73219    24.5   1.473535 0.6916593          ?        ? 
1 1 1   27   21   11 o 14.03267 4.526743   30.39823    99.8   2.255411 1.443463          ?        ? 
1 1 1   27   21   12 o 15.82831 3.988629   32.89551   123.9   2.947070 1.263030          ?        ? 
1 1 1   27   21   13 o 11.40933 4.319405   26.61566     1.9   1.413391 1.353247          ?        ? 
1 1 1   27   21   14 o 10.55613 4.050071   6.032324    85.2   1.202886 1.202886          ?        ? 
1 1 1   27   22    0 o 17.18732 3.807671   6.718976     0.0   3.398152 1.142741   3.398152 1.142741 
1 1 1   27   22    1 o 41.16866 1.241786   75.79494   207.5   17.02083 1.022453          ?        ? 
1 1 1   27   22    2 o 23.13338 2.014917   29.46113    50.5   5.412986 0.9322364          ?        ? 
1 1 1   27   22    3 o 18.64742 2.660907   38.39383   328.1   3.548513 0.9923807          ?        ? 
1 1 1   27   22    4 o 50.12051 1.199993   66.77819    81.0   25.23053 1.202886          ?        ? 
1 1 1   27   22    5 o 6.667708 3.058334   15.15579    97.4 -0.6315150 0.9322364          ?        ? 
1 1 1   27   22    6 o 41.33693 1.345854   60.19104   325.7   17.20127 1.112669          ?        ? 
1 1 1   27   22    7 o 9.316627 3.432316   12.55562   327.0  0.7518036 0.8420200          ?        ? 
1 1 1   27   22    8 o 22.71139 1.986150   19.55975   249.6   5.262625 0.9021643          ?        ? 
1 1 1   27   22    9 o 34.63062 1.345972   40.47967   319.0   12.11907 0.9322364          ?        ? 
1 1 1   27   22   10 o 17.52046 2.145502   23.32861   285.6   3.157575 0.7518036          ?        ? 
1 1 1   27   22   11 o 22.60578 3.059657   31.38589    39.9   5.473131 1.383319          ?        ? 
1 1 1   27   22   12 o 9.390927 4.001630   7.252887   153.5  0.3608657 1.323174          ?        ? 
1 1 1   27   22   13 o 9.449732 4.037386   7.927634   167.3  0.4811543 1.353247          ?        ? 
1 1 1   27   23    0 o 6.936325 4.404457   14.80321    -0.0  0.2706493 1.293102  0.2706493 1.293102 
1 1 1   27   23    1 f 23.12723 2.015452   25.63323    81.3   5.412986 0.9322364          ?        ? 
1 1 1   27   23    2 o 43.97461 1.230935   58.45126   226.2   19.42661 1.082597          ?        ? 
1 1 1   27   23    3 o 21.67405 2.358704   30.22874   178.2   4.781471 1.022453          ?        ? 
1 1 1   27   23    4 o 25.94117 2.028677   20.05972   218.2   6.826377 1.052525          ?        ? 
1 1 1   27   23    5 o 8.977916 3.676693   2.244293   357.3  0.3608657 1.052525          ?        ? 
1 1 1   27   23    6 f 39.31580 1.376796   41.42885   165.8   15.57737 1.082597          ?        ? 
1 1 1   27   23    7 o 17.26321 2.787166   16.36114    74.7   3.097431 0.9623086          ?        ? 
1 1 1   27   23    8 o 12.89868 3.517528   18.71020   139.1   1.834401 0.9322364          ?        ? 
1 1 1   27   23    9 f 8.787937 3.474257   25.48810   184.3  0.5412986 0.9021643          ?        ? 
1 1 1   27   23   10 o 10.06934 3.397082   7.655512   134.1   1.052525 0.8119479          ?        ? 
1 1 1   27   23   11 o 17.96057 2.009212   11.49995   113.6   3.338008 0.7217315          ?        ? 
1 1 1   27   23   12 o 14.42110 4.218272   21.66977    89.8   2.556132 1.293102          ?        ? 
1 1 1   27   23   13 o 7.237707 3.409446   4.327467   139.3 -0.9623086 1.293102          ?        ? 
1 1 1   27   24    0 o 11.14828 5.220751   4.436221   180.0   1.894545 1.293102   1.894545 1.293102 
1 1 1   27   24    1 o 8.372460 3.376744   12.25356   268.5  0.3608657 0.8720922          ?        ? 
1 1 1   27   24    2 o 41.45890 1.305627   58.19656   327.4   17.29148 1.082597          ?        ? 
1 1 1   27   24    3 o 38.86306 1.431525   56.39997     1.7   15.21651 1.112669          ?        ? 
1 1 1   27   24    4 o 14.19901 3.677773   32.62107     6.5   2.195267 1.052525          ?        ? 
1 1 1   27   24    5 o 12.98328 3.588569   19.80986    46.8   1.834401 0.9623086          ?        ? 
1 1 1   27   24    6 o 25.91661 2.030600   36.10312   229.0   6.856449 1.052525          ?        ? 
1 1 1   27   24    7 o 20.20015 2.456370   23.89093   106.5   4.210100 0.9923807          ?        ? 
1 1 1   27   24    8 o 32.98761 1.504172   47.11379    50.3   11.03648 0.9923807          ?        ? 
1 1 1   27   24    9 o 13.38078 3.279755   17.02067   127.6   1.984761 0.8720922          ?        ? 
1 1 1   27   24   10 o 23.04655 1.957265   22.42057    39.9   5.473131 0.9021643          ?        ? 
1 1 1   27   24   11 o 11.42638 3.176759   10.40390    48.5   1.473535 0.7518036          ?        ? 
1 1 1   27   24   12 o 9.348180 4.017073   16.59260   152.7  0.4210100 1.353247          ?        ? 
1 1 1   27   25    0 o 72.76344 1.489221   94.53714   180.0   53.22770 2.165194   53.22770 2.165194 
1 1 1   27   25    1 o 14.29507 3.135864   21.71594   262.7   2.195267 0.8720922          ?        ? 
1 1 1   27   25    2 o 35.23120 1.451062   41.43929   103.7   12.51001 1.022453          ?        ? 
1 1 1   27   25    3 o 19.61473 2.453026   29.04177     9.9   3.939451 0.9623086          ?        ? 
1 1 1   27   25    4 o 10.19230 3.677599   18.60609   347.2  0.9623086 0.9623086          ?        ? 
1 1 1   27   25    5 o 31.08390 1.693039   34.94910   167.1   9.803518 1.052525          ?        ? 
1 1 1   27   25    6 f 31.07682 1.693424   39.17986    56.3   9.803518 1.052525          ?        ? 
1 1 1   27   25    7 f 23.28272 2.260314   31.63542   257.6   5.593419 1.052525          ?        ? 
1 1 1   27   25    8 o 10.31061 3.733204   15.43072   188.2   1.022453 0.9923807          ?        ? 
1 1 1   27   25    9 o 10.26220 3.574645   13.04880    14.9   1.082597 0.9021643          ?        ? 
1 1 1   27   25   10 o 18.24122 2.555302   15.17595     7.4   3.518441 0.9322364          ?        ? 
1 1 1   27   25   11 o 21.24189 2.052765   29.41486   357.1   4.721327 0.8720922          ?        ? 
1 1 1   27   25   12 o 7.731646 2.995225   18.25411    39.4  0.5112265 0.6615872          ?        ? 
1 1 1   27   26    0 o 40.11261 1.921129   56.75165    -0.0   16.32917 1.533679   16.32917 1.533679 
1 1 1   27   26    1 o 14.80322 3.237800   18.40881   307.6   2.375700 0.9322364          ?        ? 
1 1 1   27   26    2 o 21.03428 2.358961   36.99697    26.7   4.540894 0.9923807          ?        ? 
1 1 1   27   26    3 f 32.84021 1.556709   36.74080   117.8   10.91619 1.022453          ?        ? 
1 1 1   27   26    4 o 35.54927 1.480375   41.08848    99.5   12.78066 1.052525          ?        ? 
1 1 1   27   26    5 o 15.83738 3.510728   16.64913    94.7   2.766637 1.082597          ?        ? 
1 1 1   27   26    6 o 18.23461 2.803606   11.28186   286.8   3.488369 1.022453          ?        ? 
1 1 1   27   26    7 o 7.249116 3.298670   18.38729   230.0 -0.5112265 1.052525          ?        ? 
1 1 1   27   26    8 o 18.48245 2.603303   24.87757    41.7   3.578585 0.9623086          ?        ? 
1 1 1   27   26    9 o 7.723382 3.379943   7.489171   106.4      -0.03 0.9923807          ?        ? 
1 1 1   27   26   10 o 16.46719 2.936122   21.76351   279.5   3.007215 0.9322364          ?        ? 
1 1 1   27   26   11 o 9.310385 3.480875   11.94989   232.7  0.8720922 0.8720922          ?        ? 
1 1 1   27   27    0 o 7.786389 4.628454   11.25342   360.0  0.7818757 1.232958  0.7818757 1.232958 
1 1 1   27   27    1 f 8.364464 3.510171   16.19814   172.0  0.2105050 0.9923807          ?        ? 
1 1 1   27   27    2 o 16.30876 2.967821   18.79342   196.9   2.856854 0.9322364          ?        ? 
1 1 1   27   27    3 o 15.30609 3.242577   13.43224    68.1   2.556132 0.9623086          ?        ? 
1 1 1   27   27    4 o 32.11418 1.591903   46.58313   125.7   10.46511 1.022453          ?        ? 
1 1 1   27   27    5 o 31.52776 1.621512   38.93555   231.4   10.10424 1.022453          ?        ? 
1 1 1   27   27    6 o 8.371578 3.511527   8.614896   304.3  0.2405772 0.9923807          ?        ? 
1 1 1   27   27    7 o 33.62846 1.743781   45.74804   332.3   11.54770 1.172814          ?        ? 
1 1 1   27   27    8 o 16.41520 3.229400   25.53267   330.8   3.007215 1.022453          ?        ? 
1 1 1   27   27    9 o 33.13081 1.633822   41.62389   177.3   11.24698 1.082597          ?        ? 
1 1 1   27   27   10 o 14.52185 3.374619   27.89721   218.3   2.465916 0.9623086          ?        ? 
1 1 1   27   27   11 o 16.08072 3.102852   19.21870   283.7   2.977142 0.9623086          ?        ? 
1 1 1   27   28    0 o 23.98435 3.024576   32.65105   180.0   6.164790 1.413391   6.164790 1.413391 
1 1 1   27   28    1 o 28.82913 1.877610   38.16612    14.2   8.480345 1.082597          ?        ? 
1 1 1   27   28    2 o 9.123789 3.594147   21.47360   259.8  0.6014429 0.9623086          ?        ? 
1 1 1   27   28    3 o 15.72135 3.171694   18.88398   282.8   2.706493 0.9623086          ?        ? 
1 1 1   27   28    4 o 9.346539 3.658572   30.23649   202.8  0.6615872 0.9923807          ?        ? 
1 1 1   27   28    5 o 9.887430 3.709895   26.04499   240.4  0.8720922 0.9923807          ?        ? 
1 1 1   27   28    6 o 19.71179 2.517227   20.31733   188.2   4.059740 0.9923807          ?        ? 
1 1 1   27   28    7 o 6.423845 3.015547   16.41098   338.3 -0.8720922 0.9923807          ?        ? 
1 1 1   27   28    8 o 17.29562 3.160165   21.77531    64.3   3.338008 1.052525          ?        ? 
1 1 1   27   28    9 o 18.52792 2.759222   19.00808   104.4   3.728946 1.022453          ?        ? 
1 1 1   27   28   10 f 25.56989 2.058134   31.19803   255.6   6.886521 1.052525          ?        ? 
1 1 1   27   29    0 o 5.320609 3.695986   3.101705     0.0 -0.8119479 1.293102 -0.8119479 1.293102 
1 1 1   27   29    1 o 24.45853 2.028700   26.52090   125.7   6.134717 0.9923807          ?        ? 
1 1 1   27   29    2 o 22.33767 2.221316   22.76978    62.6   5.142337 0.9923807          ?        ? 
1 1 1   27   29    3 f 11.93038 4.130335   7.502796    61.9   1.503607 1.202886          ?        ? 
1 1 1   27   29    4 o 7.500868 3.407449   12.44749   159.8 -0.4811543 1.112669          ?        ? 
1 1 1   27   29    5 o 20.98777 2.794041   37.45679   208.6   4.661182 1.172814          ?        ? 
1 1 1   27   29    6 o 19.52565 2.926258   31.15147   208.7   4.089812 1.142741          ?        ? 
1 1 1   27   29    7 o 7.858567 3.519208   7.789817    96.5 -0.2405772 1.142741          ?        ? 
1 1 1   27   29    8 o 23.27731 2.906793   26.22756    33.4   5.924213 1.353247          ?        ? 
1 1 1   27   29    9 o 10.36050 4.106106   12.24280   208.0   1.052525 1.263030          ?        ? 
1 1 1   27   30    0 o 9.245371 5.237642   4.251893   360.0   1.323174 1.473535   1.323174 1.473535 
1 1 1   27   30    1 o 17.04790 3.383613   17.02839   325.7   3.217719 1.112669          ?        ? 
1 1 1   27   30    2 o 37.28589 1.734037   35.94167   175.3   14.19405 1.293102          ?        ? 
1 1 1   27   30    3 o 19.59062 3.146806   31.76257   286.5   4.119884 1.232958          ?        ? 
1 1 1   27   30    4 o 14.57374 3.858972   21.27759   172.6   2.465916 1.142741          ?        ? 
1 1 1   27   30    5 o 7.922068 3.513838   19.37527   259.2 -0.1503607 1.112669          ?        ? 
1 1 1   27   30    6 o 30.39914 2.027949   40.74604   264.1   9.593014 1.232958          ?        ? 
1 1 1   27   30    7 f 16.29740 3.841056   14.52570   242.4   3.187647 1.232958          ?        ? 
1 1 1   27   30    8 o 7.501145 3.436308   14.26250   136.0 -0.4510822 1.172814          ?        ? 
1 1 1   27   31    0 o 20.88417 5.250871   22.03953   180.0   5.473131 1.894545   5.473131 1.894545 
1 1 1   27   31    1 o 9.641179 4.168090   17.38672   185.8  0.2405772 1.473535          ?        ? 
1 1 1   27   31    2 o 21.88711 2.679234   28.90741   228.5   5.082192 1.172814          ?        ? 
1 1 1   27   31    3 o 20.62856 2.915583   20.98635    88.8   4.570966 1.202886          ?        ? 
1 1 1   27   31    4 o 22.01484 2.731989   23.16769   355.0   5.172409 1.202886          ?        ? 
1 1 1   27   31    5 o 25.87044 2.382947   30.32395    27.6   7.066954 1.232958          ?        ? 
1 1 1   27   31    6 o 6.166564 3.006240   7.920941   212.3  -1.804329 1.202886          ?        ? 
1 1 1   27   31    7 o 18.16654 3.519078   23.35644   253.4   3.879307 1.232958          ?        ? 
1 1 1   27   32    0 o 22.38924 5.429008   19.92775   360.0   6.315150 2.105050   6.315150 2.105050 
1 1 1   27   32    1 o 8.907654 3.972984   13.60302    55.4 -0.1503607 1.443463          ?        ? 
1 1 1   27   32    2 o 16.81347 4.414882   19.72532   357.0   3.458297 1.503607          ?        ? 
1 1 1   27   32    3 o 7.322686 3.387115   17.01780    38.3 -0.6615872 1.172814          ?        ? 
1 1 1   27   32    4 o 12.53575 4.082782   24.43117   302.1   1.894545 1.172814          ?        ? 
1 1 1   27   32    5 o 13.91396 4.253222   26.86575    67.4   2.435844 1.293102          ?        ? 
1 1 1   27   32    6 o 7.640446 3.465497   1.418108   238.0 -0.2706493 1.142741          ?        ? 
1 1 1   27   33    0 o 8.781161 5.558251  0.3035800   180.0  0.9623086 2.044906  0.9623086 2.044906 
1 1 1   27   33    1 o 10.75754 4.254398   13.03437   330.5   1.142741 1.353247          ?        ? 
1 1 1   27   33    2 o 20.17413 3.716885   18.90633    68.6   4.811543 1.443463          ?        ? 
1 1 1   27   33    3 o 9.147540 3.975027   6.980024    61.1  0.3007214 1.353247          ?        ? 
1 1 1   27   33    4 o 10.00154 3.993471   10.99324   285.4  0.9322364 1.202886          ?        ? 
1 1 1   27   33    5 o 23.11431 2.732139   28.55043    90.4   5.864068 1.263030          ?        ? 
1 1 1   27   34    0 o 8.241487 5.443428   11.56406   180.0  0.4510822 2.225339  0.4510822 2.225339 
1 1 1   27   34    1 o 14.56740 4.388406   18.86173   197.6   2.736565 1.383319          ?        ? 
1 1 1   27   34    2 o 9.021128 4.001662   4.273688   336.7  0.1202886 1.443463          ?        ? 
1 1 1   27   34    3 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   28    0    0 o 34.93661 2.744678   38.32111   180.0   12.44987 1.894545   12.44987 1.894545 
1 1 1   28    0    1 o 28.92995 2.262085   65.81312     0.0   8.540489 1.293102   8.540489 1.293102 
1 1 1   28    0    2 o 51.43914 1.493550   88.15608   180.0   26.55371 1.533679   26.55371 1.533679 
1 1 1   28    0    3 o 32.87052 2.216162   63.57839   180.0   10.97633 1.443463   10.97633 1.443463 
1 1 1   28    0    4 o 5.882562 3.962686  0.9646230     0.0 -0.4510822 1.293102 -0.4510822 1.293102 
1 1 1   28    0    5 o 58.67548 1.385510   76.91045     0.0   34.52282 1.623896   34.52282 1.623896 
1 1 1   28    0    6 o 79.98132 1.448621   104.6746     0.0   64.11382 2.315555   64.11382 2.315555 
1 1 1   28    0    7 o 45.49298 1.590723   51.29203     0.0   20.80992 1.443463   20.80992 1.443463 
1 1 1   28    0    8 o 60.81433 1.262163   50.78466     0.0   37.07896 1.533679   37.07896 1.533679 
1 1 1   28    0    9 o 51.76013 1.250751   83.74445     0.0   26.88450 1.293102   26.88450 1.293102 
1 1 1   28    0   10 o 11.14445 3.776153   11.06256     0.0   1.623896 0.7518036   1.623896 0.7518036 
1 1 1   28    0   11 o 14.16086 7.419899   27.63709   180.0   3.217719 2.736565   3.217719 2.736565 
1 1 1   28    0   12 o 32.62679 4.519289   43.33163   180.0   11.33720 2.886926   11.33720 2.886926 
1 1 1   28    0   13 o 12.39664 6.206797   19.45704     0.0   2.495988 1.864473   2.495988 1.864473 
1 1 1   28    0   14 f 11.30985 6.918174   13.56072     0.0   1.834401 2.916998   1.834401 2.916998 
1 1 1   28    0   15 x        ?      ?   21.77746   180.0          ?        ?          ?        ? 
1 1 1   28    0   16 o 12.68610 7.302657   30.16670   180.0   3.127503 2.916998   3.127503 2.916998 
1 1 1   28    0   17 o 10.69333 6.100239   6.596692     0.0   2.165194 2.014834   2.165194 2.014834 
1 1 1   28    1    0 o 36.16938 2.050790   80.62797   180.0   13.23174 1.473535   13.23174 1.473535 
1 1 1   28    1    1 o 20.54784 2.195278   33.60214   323.0   4.240172 0.9021643          ?        ? 
1 1 1   28    1    2 o 82.91356 0.9611358   132.9089     4.4   68.80507 1.593824          ?        ? 
1 1 1   28    1    3 o 9.847481 3.506135   19.66080   315.0  0.8420200 0.8720922          ?        ? 
1 1 1   28    1    4 o 17.87877 2.607104   35.11340   133.8   3.217719 0.9322364          ?        ? 
1 1 1   28    1    5 o 12.01536 3.368985   25.34393    56.9   1.503607 0.8420200          ?        ? 
1 1 1   28    1    6 o 25.62414 1.584342   42.46925   352.6   6.585800 0.8119479          ?        ? 
1 1 1   28    1    7 o 11.88596 3.380743   21.41323   169.9   1.473535 0.8420200          ?        ? 
1 1 1   28    1    8 o 41.86784 1.077395   72.75640   103.8   17.56213 0.9021643          ?        ? 
1 1 1   28    1    9 o 24.81571 1.635956   50.86499   340.1   6.194862 0.8119479          ?        ? 
1 1 1   28    1   10 o 35.46932 1.229361   49.55120     5.5   12.63030 0.8720922          ?        ? 
1 1 1   28    1   11 o 7.295950 3.152444   7.444149   230.6      -0.06 0.8420200          ?        ? 
1 1 1   28    1   12 o 28.36786 3.233238   40.57235   288.0   8.360056 1.834401          ?        ? 
1 1 1   28    1   13 f 35.79711 2.688230   45.18876   245.3   13.29189 1.924617          ?        ? 
1 1 1   28    1   14 o 17.49710 4.708219   20.54981     9.3   3.608657 1.684040          ?        ? 
1 1 1   28    1   15 o 12.95342 5.592704   6.738672   154.1  0.9923807 2.646349          ?        ? 
1 1 1   28    1   16 o 15.21451 5.147782   15.21876   244.7   3.007215 1.864473          ?        ? 
1 1 1   28    1   17 o 12.81636 5.349694   18.39728   226.0   1.984761 2.285483          ?        ? 
1 1 1   28    2    0 o 21.91158 2.819768   33.03886   180.0   5.052120 1.202886   5.052120 1.202886 
1 1 1   28    2    1 o 15.49049 2.921793   8.632013   285.5   2.495988 0.8720922          ?        ? 
1 1 1   28    2    2 o 48.77490 1.109789   46.53638   351.2   23.81714 1.082597          ?        ? 
1 1 1   28    2    3 o 57.71937 1.042012   80.27013   343.1   33.35001 1.202886          ?        ? 
1 1 1   28    2    4 o 13.32859 3.465416   22.00832   249.2   1.864473 0.9322364          ?        ? 
1 1 1   28    2    5 o 30.09706 1.498759   51.43133   161.8   9.081788 0.9021643          ?        ? 
1 1 1   28    2    6 o 46.43322 1.100993   83.32457    97.3   21.59180 1.022453          ?        ? 
1 1 1   28    2    7 o 9.760031 3.392023   17.37237   133.1  0.8720922 0.8119479          ?        ? 
1 1 1   28    2    8 o 25.47949 1.770374   46.70366   114.1   6.525656 0.9021643          ?        ? 
1 1 1   28    2    9 o 43.92500 0.9927062   52.52653   220.1   19.33639 0.8720922          ?        ? 
1 1 1   28    2   10 o 7.377125 3.138824   3.490219   149.3       0.03 0.8119479          ?        ? 
1 1 1   28    2   11 o 7.551176 3.262910   16.90415   145.3      -0.06 0.9021643          ?        ? 
1 1 1   28    2   12 o 19.09484 1.968604   28.05317   212.9   3.698874 0.7518036          ?        ? 
1 1 1   28    2   13 o 23.54374 4.242161   35.54720   288.1   6.194862 1.924617          ?        ? 
1 1 1   28    2   14 o 12.08778 4.814328   9.583275   255.1   1.202886 1.744184          ?        ? 
1 1 1   28    2   15 o 21.84101 3.304478   33.85923   104.1   5.172409 1.443463          ?        ? 
1 1 1   28    2   16 o 32.00530 5.261754   26.08594    34.7   13.11145 3.368080          ?        ? 
1 1 1   28    2   17 o 16.03840 5.645673   18.09338   358.6   3.909379 2.255411          ?        ? 
1 1 1   28    3    0 o 10.53185 5.080606   41.63734   180.0   1.653968 1.232958   1.653968 1.232958 
1 1 1   28    3    1 o 16.22344 2.984880   18.41067   158.0   2.736565 0.9322364          ?        ? 
1 1 1   28    3    2 o 58.21283 1.033179   77.16452   104.5   33.92138 1.202886          ?        ? 
1 1 1   28    3    3 o 42.65974 1.198382   73.74358    96.1   18.22372 1.022453          ?        ? 
1 1 1   28    3    4 o 34.51904 1.393881   59.35073   256.5   11.93864 0.9623086          ?        ? 
1 1 1   28    3    5 o 66.08740 0.9783273   97.05203   259.3   43.72490 1.293102          ?        ? 
1 1 1   28    3    6 o 18.53932 2.270903   27.68646   232.5   3.458297 0.8420200          ?        ? 
1 1 1   28    3    7 o 36.74161 1.268639   55.19987   177.8   13.53246 0.9322364          ?        ? 
1 1 1   28    3    8 o 31.11742 1.352972   64.26266   264.1   9.713303 0.8420200          ?        ? 
1 1 1   28    3    9 o 19.71583 1.601543   33.59732    96.3   3.909379 0.6315150          ?        ? 
1 1 1   28    3   10 o 14.46362 3.104259   10.50327   195.6   2.225339 0.8720922          ?        ? 
1 1 1   28    3   11 o 24.77684 1.699208   31.47528   175.7   6.194862 0.8420200          ?        ? 
1 1 1   28    3   12 o 24.23299 1.923486   31.16310   180.6   5.954284 0.9322364          ?        ? 
1 1 1   28    3   13 o 22.93664 1.507761   32.31987   146.2   5.322770 0.6916593          ?        ? 
1 1 1   28    3   14 o 7.444721 3.610574   13.80287    57.8  -2.465916 1.684040          ?        ? 
1 1 1   28    3   15 o 12.43720 4.914488   12.47212    44.0   1.473535 1.804329          ?        ? 
1 1 1   28    3   16 o 9.491438 4.471558   17.10422   213.3  -1.293102 2.225339          ?        ? 
1 1 1   28    4    0 o 23.63649 2.599387   24.42155   180.0   5.803924 1.202886   5.803924 1.202886 
1 1 1   28    4    1 o 28.30024 1.647047   57.00269   282.3   8.029263 0.9322364          ?        ? 
1 1 1   28    4    2 o 90.28326 0.9826056   120.5965   224.0   81.58572 1.774257          ?        ? 
1 1 1   28    4    3 o 76.62006 0.9812099   126.3763   260.5   58.76097 1.503607          ?        ? 
1 1 1   28    4    4 o 77.10862 0.9554932   107.1796   242.9   59.51277 1.473535          ?        ? 
1 1 1   28    4    5 o 56.57604 1.116223   96.84570   259.8   32.05691 1.263030          ?        ? 
1 1 1   28    4    6 o 10.90361 3.640025   8.127542   342.6   1.142741 0.9322364          ?        ? 
1 1 1   28    4    7 o 8.235674 3.355391   13.39438   213.1  0.2706493 0.8720922          ?        ? 
1 1 1   28    4    8 o 22.07233 1.839289   48.83273   249.3   4.901759 0.8119479          ?        ? 
1 1 1   28    4    9 o 18.21047 2.642184   21.67263   183.7   3.368080 0.9623086          ?        ? 
1 1 1   28    4   10 o 28.32979 1.698404   45.52965   150.9   8.089407 0.9623086          ?        ? 
1 1 1   28    4   11 o 10.57857 3.393318   19.15452   143.1   1.142741 0.8119479          ?        ? 
1 1 1   28    4   12 o 7.770007 3.390298   8.484367   111.8 -0.1202886 0.9923807          ?        ? 
1 1 1   28    4   13 o 12.81679 3.444825   15.77458   136.6   1.804329 0.9021643          ?        ? 
1 1 1   28    4   14 o 7.740133 3.129644   9.700700   145.2  0.3307936 0.7518036          ?        ? 
1 1 1   28    4   15 o 13.02832 4.971386   23.38037   101.2   1.804329 1.804329          ?        ? 
1 1 1   28    4   16 o 10.95296 4.583320   25.18665   149.7  0.9322364 1.684040          ?        ? 
1 1 1   28    5    0 o 100.3085 1.409667   149.7649    -0.0   100.7718 2.826782   100.7718 2.826782 
1 1 1   28    5    1 o 55.92323 1.021706   72.39326    31.4   31.30510 1.142741          ?        ? 
1 1 1   28    5    2 o 50.34989 1.104937   67.78596   353.3   25.38089 1.112669          ?        ? 
1 1 1   28    5    3 o 52.21926 1.180558   74.51501     7.6   27.30551 1.232958          ?        ? 
1 1 1   28    5    4 o 71.43678 1.052404   120.1043    21.5   51.09257 1.503607          ?        ? 
1 1 1   28    5    5 o 34.72309 1.472295   44.04113   216.7   12.08900 1.022453          ?        ? 
1 1 1   28    5    6 o 15.51284 3.210279   25.58874   209.0   2.526060 0.9623086          ?        ? 
1 1 1   28    5    7 o 15.25435 2.964284   16.06434   357.0   2.435844 0.8720922          ?        ? 
1 1 1   28    5    8 o 37.13953 1.214561   70.80202   346.9   13.83319 0.9021643          ?        ? 
1 1 1   28    5    9 o 43.20728 1.252795   71.87750    31.8   18.73495 1.082597          ?        ? 
1 1 1   28    5   10 o 24.75024 2.004790   37.35726   242.9   6.194862 0.9923807          ?        ? 
1 1 1   28    5   11 o 6.756464 3.023390   7.840422   336.8 -0.3307936 0.8420200          ?        ? 
1 1 1   28    5   12 o 30.05686 1.950992   45.64072   285.0   9.172004 1.172814          ?        ? 
1 1 1   28    5   13 o 13.78576 3.650176   16.45010   249.8   2.105050 1.022453          ?        ? 
1 1 1   28    5   14 o 5.589618 2.734394   1.427249   206.4  -1.834401 1.022453          ?        ? 
1 1 1   28    5   15 o 6.116242 2.863155   15.13365   146.0 -0.7217315 0.8720922          ?        ? 
1 1 1   28    5   16 o 11.75242 4.558847   17.61559   227.1   1.503607 1.533679          ?        ? 
1 1 1   28    6    0 o 9.222330 5.198775   21.51981     0.0   1.172814 1.443463   1.172814 1.443463 
1 1 1   28    6    1 o 33.14232 1.451782   26.84805   283.8   11.00640 0.9623086          ?        ? 
1 1 1   28    6    2 o 28.23812 1.810413   56.27203    59.1   7.999191 1.022453          ?        ? 
1 1 1   28    6    3 o 64.33483 1.098465   106.3018   213.4   41.43941 1.413391          ?        ? 
1 1 1   28    6    4 o 25.01053 2.044045   57.22103   127.3   6.285078 1.022453          ?        ? 
1 1 1   28    6    5 o 11.61452 3.481483   21.63316    73.5   1.383319 0.8720922          ?        ? 
1 1 1   28    6    6 o 47.40849 1.268640   69.15891   260.3   22.52404 1.202886          ?        ? 
1 1 1   28    6    7 o 59.77036 1.056569   85.51804   234.8   35.78585 1.263030          ?        ? 
1 1 1   28    6    8 o 37.53824 1.201660   55.67116   284.5   14.13391 0.9021643          ?        ? 
1 1 1   28    6    9 o 22.68428 2.187375   37.05358   185.7   5.202481 0.9923807          ?        ? 
1 1 1   28    6   10 o 25.00627 1.864006   30.89800    88.7   6.315150 0.9322364          ?        ? 
1 1 1   28    6   11 o 7.918190 3.335958   21.34065    58.6  0.1202886 0.9021643          ?        ? 
1 1 1   28    6   12 o 28.32947 2.123029   48.82639    68.1   8.179624 1.202886          ?        ? 
1 1 1   28    6   13 o 19.55037 2.691829   26.04746    25.5   3.969523 1.052525          ?        ? 
1 1 1   28    6   14 o 9.873158 3.907980   7.414263   264.9  0.7217315 1.142741          ?        ? 
1 1 1   28    6   15 o 16.90213 3.229104   27.49801   148.0   3.187647 1.052525          ?        ? 
1 1 1   28    6   16 o 9.860148 3.829090   17.35106   218.3  0.9322364 1.082597          ?        ? 
1 1 1   28    7    0 o 84.73984 1.544858   117.8765   180.0   71.96265 2.616277   71.96265 2.616277 
1 1 1   28    7    1 o 36.24681 1.617817   40.34732   134.1   13.17160 1.172814          ?        ? 
1 1 1   28    7    2 o 104.2831 1.268830   154.0631   137.6   108.9213 2.646349          ?        ? 
1 1 1   28    7    3 o 67.16123 1.141789   104.4421   183.5   45.16836 1.533679          ?        ? 
1 1 1   28    7    4 o 23.38315 2.314909   50.42426   166.3   5.503202 1.082597          ?        ? 
1 1 1   28    7    5 o 27.41338 1.919729   41.55270   129.4   7.548109 1.052525          ?        ? 
1 1 1   28    7    6 o 25.24614 1.846295   34.98307   115.9   6.405366 0.9322364          ?        ? 
1 1 1   28    7    7 o 69.48023 1.038758   88.87468    90.4   48.35601 1.443463          ?        ? 
1 1 1   28    7    8 o 25.73315 1.285477   40.61368    92.7   6.645944 0.6615872          ?        ? 
1 1 1   28    7    9 o 20.81312 2.384027   40.75668    21.9   4.390533 0.9923807          ?        ? 
1 1 1   28    7   10 o 36.69187 1.598193   49.41114    15.4   13.56254 1.172814          ?        ? 
1 1 1   28    7   11 o 21.32652 2.256132   30.19429    13.1   4.631110 0.9623086          ?        ? 
1 1 1   28    7   12 o 27.37772 1.812387   47.85618    53.0   7.608253 0.9923807          ?        ? 
1 1 1   28    7   13 o 18.02943 3.377373   21.00225     1.1   3.548513 1.172814          ?        ? 
1 1 1   28    7   14 o 10.50854 3.971937   22.70984   342.5  0.9923807 1.142741          ?        ? 
1 1 1   28    7   15 o 17.50565 3.799976   23.63372   242.9   3.548513 1.293102          ?        ? 
1 1 1   28    7   16 o 9.139964 3.950536   19.42743   208.0  0.3307936 1.323174          ?        ? 
1 1 1   28    8    0 o 5.339030 3.707706   10.84285   180.0 -0.9021643 1.293102 -0.9021643 1.293102 
1 1 1   28    8    1 o 18.92002 2.860984   31.22783   317.3   3.608657 1.082597          ?        ? 
1 1 1   28    8    2 o 75.83504 1.149986   110.9897    88.2   57.58816 1.744184          ?        ? 
1 1 1   28    8    3 o 27.95551 1.936286   35.73091   355.2   7.848830 1.082597          ?        ? 
1 1 1   28    8    4 o 48.53152 1.363211   72.32890   143.8   23.60663 1.323174          ?        ? 
1 1 1   28    8    5 o 15.39060 3.411922   24.53064   140.9   2.495988 1.022453          ?        ? 
1 1 1   28    8    6 o 49.69284 1.210321   74.11329    18.3   24.74938 1.202886          ?        ? 
1 1 1   28    8    7 o 24.37233 2.097569   47.19467   309.0   5.984357 1.022453          ?        ? 
1 1 1   28    8    8 o 48.76240 0.8633907   62.82892   167.7   23.81714 0.8420200          ?        ? 
1 1 1   28    8    9 o 44.06403 1.433176   63.58850   203.3   19.51682 1.263030          ?        ? 
1 1 1   28    8   10 o 55.56979 1.298784   94.96156   178.5   31.03445 1.443463          ?        ? 
1 1 1   28    8   11 f 15.11269 3.370123   22.29917    87.8   2.465916 0.9923807          ?        ? 
1 1 1   28    8   12 o 6.703928 3.106558   14.33721    81.4 -0.7518036 0.9923807          ?        ? 
1 1 1   28    8   13 o 24.88836 2.718633   34.91644   245.3   6.465511 1.353247          ?        ? 
1 1 1   28    8   14 o 11.04002 4.244358   8.567951   352.0   1.082597 1.323174          ?        ? 
1 1 1   28    8   15 o 12.00980 4.401780   14.44175   297.6   1.563751 1.383319          ?        ? 
1 1 1   28    8   16 o 10.20822 3.940244   14.86211   235.4   1.052525 1.142741          ?        ? 
1 1 1   28    9    0 o 17.15218 4.672645   34.36063   180.0   3.548513 1.383319   3.548513 1.383319 
1 1 1   28    9    1 o 78.72874 1.145915   127.4958    24.0   62.06890 1.804329          ?        ? 
1 1 1   28    9    2 o 71.25394 1.181717   111.2080   326.7   50.85200 1.684040          ?        ? 
1 1 1   28    9    3 o 55.57713 1.217449   86.49313   134.9   30.94424 1.353247          ?        ? 
1 1 1   28    9    4 o 36.85587 1.550284   44.00144   187.4   13.62268 1.142741          ?        ? 
1 1 1   28    9    5 o 51.88453 1.217155   87.25066   228.4   26.97471 1.263030          ?        ? 
1 1 1   28    9    6 f 40.75214 1.438959   50.59538   324.4   16.65997 1.172814          ?        ? 
1 1 1   28    9    7 o 22.27089 1.822891   42.41294    80.5   4.991976 0.8119479          ?        ? 
1 1 1   28    9    8 o 40.59301 0.9260259   65.67380   336.6   16.50961 0.7518036          ?        ? 
1 1 1   28    9    9 o 18.38326 2.944519   42.58530   135.0   3.458297 1.082597          ?        ? 
1 1 1   28    9   10 o 33.80869 1.823434   54.15183   300.1   11.54770 1.232958          ?        ? 
1 1 1   28    9   11 o 21.47802 2.520244   32.08398   260.5   4.721327 1.082597          ?        ? 
1 1 1   28    9   12 o 9.803800 3.824585   13.63080   137.5  0.7217315 1.082597          ?        ? 
1 1 1   28    9   13 o 24.38491 3.021408   34.07849   109.2   6.285078 1.473535          ?        ? 
1 1 1   28    9   14 o 9.956864 4.107479   12.44485   235.8  0.5713707 1.323174          ?        ? 
1 1 1   28    9   15 o 10.81252 4.226160   5.053966   224.7   1.082597 1.323174          ?        ? 
1 1 1   28    9   16 o 10.87601 4.269184   12.87898     6.9   1.232958 1.353247          ?        ? 
1 1 1   28   10    0 o 10.13747 5.485019   27.45058     0.0   1.503607 1.533679   1.503607 1.533679 
1 1 1   28   10    1 o 32.43837 1.622346   44.73976   189.8   10.55532 1.052525          ?        ? 
1 1 1   28   10    2 o 47.16072 1.243422   74.03783    41.3   22.28346 1.172814          ?        ? 
1 1 1   28   10    3 o 46.68291 1.223940   69.11970    69.4   21.83238 1.142741          ?        ? 
1 1 1   28   10    4 o 41.81735 1.438262   53.63155   321.8   17.53206 1.202886          ?        ? 
1 1 1   28   10    5 o 46.08258 1.305142   47.44207   294.4   21.29108 1.202886          ?        ? 
1 1 1   28   10    6 o 20.77757 2.532840   32.59178     4.5   4.360461 1.052525          ?        ? 
1 1 1   28   10    7 o 33.69899 1.293944   41.68462    27.7   11.39734 0.8720922          ?        ? 
1 1 1   28   10    8 o 24.65653 1.341607   31.41033    60.1   6.104645 0.6615872          ?        ? 
1 1 1   28   10    9 o 24.19118 2.486208   39.43076   134.3   5.954284 1.202886          ?        ? 
1 1 1   28   10   10 o 13.49471 3.971262   32.87070   272.7   1.954689 1.142741          ?        ? 
1 1 1   28   10   11 o 7.394769 3.341432   8.987729    55.8 -0.4811543 1.052525          ?        ? 
1 1 1   28   10   12 o 8.794446 3.677114   7.874427   168.0  0.2706493 1.082597          ?        ? 
1 1 1   28   10   13 o 19.35378 2.641481   21.14389   134.4   3.909379 1.022453          ?        ? 
1 1 1   28   10   14 o 10.39709 4.173388   11.52225   305.7  0.8119479 1.323174          ?        ? 
1 1 1   28   10   15 o 22.89886 3.283149   36.26783   329.3   5.773852 1.503607          ?        ? 
1 1 1   28   10   16 o 12.17801 4.493053   11.25819     7.4   1.804329 1.443463          ?        ? 
1 1 1   28   11    0 o 32.21244 2.407306   67.04300   180.0   10.58539 1.533679   10.58539 1.533679 
1 1 1   28   11    1 o 43.13329 1.324663   64.63963   278.2   18.64473 1.142741          ?        ? 
1 1 1   28   11    2 o 46.77732 1.253614   76.07569   288.9   21.92259 1.172814          ?        ? 
1 1 1   28   11    3 o 21.85810 2.407632   41.06596   148.2   4.811543 1.052525          ?        ? 
1 1 1   28   11    4 f 54.50588 1.213791   60.65680   117.4   29.77142 1.323174          ?        ? 
1 1 1   28   11    5 o 30.90009 1.751770   59.99538    45.1   9.593014 1.082597          ?        ? 
1 1 1   28   11    6 o 25.18130 1.731627   52.55845    86.5   6.375295 0.8720922          ?        ? 
1 1 1   28   11    7 o 22.78843 1.847473   38.21751   126.2   5.232553 0.8420200          ?        ? 
1 1 1   28   11    8 o 36.85816 1.060655   68.73328    89.6   13.62268 0.7818757          ?        ? 
1 1 1   28   11    9 o 31.93614 1.977430   45.52531   157.5   10.31474 1.263030          ?        ? 
1 1 1   28   11   10 o 34.16350 1.892520   46.84875   236.3   11.81835 1.293102          ?        ? 
1 1 1   28   11   11 o 8.425066 3.631868   20.81899     0.7   0.000000 1.112669          ?        ? 
1 1 1   28   11   12 o 10.93654 3.953664   18.72565   227.9   1.142741 1.112669          ?        ? 
1 1 1   28   11   13 o 35.96725 1.714001   48.33548   292.8   13.17160 1.232958          ?        ? 
1 1 1   28   11   14 o 12.57697 4.591170   17.21808   320.7   1.714112 1.503607          ?        ? 
1 1 1   28   11   15 o 9.029243 4.059212   9.091915   358.0 -0.1804329 1.533679          ?        ? 
1 1 1   28   11   16 o 9.296233 4.124115   12.76034    29.3  0.1804329 1.533679          ?        ? 
1 1 1   28   12    0 o 46.43288 1.884908   60.97797   180.0   21.71209 1.744184   21.71209 1.744184 
1 1 1   28   12    1 o 65.36423 1.150176   80.64276   253.0   42.79266 1.503607          ?        ? 
1 1 1   28   12    2 o 27.41121 1.919880   40.74287   124.6   7.548109 1.052525          ?        ? 
1 1 1   28   12    3 o 34.40244 1.617137   66.66279    96.4   11.87850 1.112669          ?        ? 
1 1 1   28   12    4 o 51.14541 1.264143   87.11961   206.1   26.22291 1.293102          ?        ? 
1 1 1   28   12    5 o 51.25800 1.290700   84.22521   227.7   26.34320 1.323174          ?        ? 
1 1 1   28   12    6 o 15.13824 2.884779   17.09218   199.1   2.405771 0.8420200          ?        ? 
1 1 1   28   12    7 o 28.99545 1.503843   34.78702   181.1   8.450273 0.8720922          ?        ? 
1 1 1   28   12    8 o 25.47111 1.475797   38.98469   150.1   6.525656 0.7518036          ?        ? 
1 1 1   28   12    9 o 22.04096 2.660532   24.73743   223.9   4.961904 1.172814          ?        ? 
1 1 1   28   12   10 o 25.94850 2.491671   27.67737   151.1   6.886521 1.293102          ?        ? 
1 1 1   28   12   11 o 18.69744 3.424737   33.09497   344.2   3.789090 1.232958          ?        ? 
1 1 1   28   12   12 o 13.54203 4.032932   10.17543    16.0   2.044906 1.172814          ?        ? 
1 1 1   28   12   13 o 23.03111 2.611438   36.37281   217.0   5.533275 1.202886          ?        ? 
1 1 1   28   12   14 o 10.17079 4.273169   15.88152   119.5  0.5713707 1.473535          ?        ? 
1 1 1   28   12   15 o 14.59469 4.661868   23.03687   199.4   2.736565 1.533679          ?        ? 
1 1 1   28   13    0 o 51.36350 1.731470   71.72549   180.0   26.52363 1.774257   26.52363 1.774257 
1 1 1   28   13    1 o 25.58576 2.115624   35.03739    26.0   6.585800 1.082597          ?        ? 
1 1 1   28   13    2 o 16.11488 3.374394   35.60794     7.4   2.736565 1.052525          ?        ? 
1 1 1   28   13    3 o 21.98586 2.256862   19.98961   221.4   4.871688 0.9923807          ?        ? 
1 1 1   28   13    4 o 50.34553 1.284228   75.22141   297.4   25.41096 1.293102          ?        ? 
1 1 1   28   13    5 o 27.89260 1.617211   45.21643   346.5   7.818758 0.9021643          ?        ? 
1 1 1   28   13    6 o 6.886141 3.034665   5.310634     7.6 -0.2105050 0.8119479          ?        ? 
1 1 1   28   13    7 o 10.21289 3.397078   10.74691   287.4   1.022453 0.8119479          ?        ? 
1 1 1   28   13    8 o 23.37308 1.608268   27.36284   221.8   5.503202 0.7518036          ?        ? 
1 1 1   28   13    9 o 13.61335 4.090443   21.69136   325.1   1.984761 1.202886          ?        ? 
1 1 1   28   13   10 o 29.93859 2.109368   48.28495    31.2   9.111859 1.263030          ?        ? 
1 1 1   28   13   11 o 14.12724 4.114737   19.85682   203.9   2.225339 1.232958          ?        ? 
1 1 1   28   13   12 o 11.91751 4.082779   19.04129   144.1   1.503607 1.172814          ?        ? 
1 1 1   28   13   13 o 21.09435 2.851203   28.92116   200.4   4.691255 1.202886          ?        ? 
1 1 1   28   13   14 o 8.897988 4.026414   19.56532   327.3 -0.3608657 1.533679          ?        ? 
1 1 1   28   13   15 o 13.25331 4.615010   17.50106   220.2   2.225339 1.503607          ?        ? 
1 1 1   28   14    0 o 30.21673 2.625396   40.36696     0.0   9.382509 1.563751   9.382509 1.563751 
1 1 1   28   14    1 o 39.81874 1.472691   64.53088    32.7   15.90816 1.172814          ?        ? 
1 1 1   28   14    2 o 35.34840 1.531324   70.63229   113.0   12.54008 1.082597          ?        ? 
1 1 1   28   14    3 o 34.83044 1.597266   47.35418   136.5   12.17922 1.112669          ?        ? 
1 1 1   28   14    4 o 10.70688 3.747242   4.368402   318.9   1.052525 0.9923807          ?        ? 
1 1 1   28   14    5 o 52.98673 1.078328   86.49620     7.7   28.14753 1.142741          ?        ? 
1 1 1   28   14    6 o 30.90297 1.411017   41.30905    89.8   9.593014 0.8720922          ?        ? 
1 1 1   28   14    7 o 54.10470 1.000465   77.76283   325.8   29.35041 1.082597          ?        ? 
1 1 1   28   14    8 o 18.07300 2.079908   29.65808    48.5   3.307936 0.7518036          ?        ? 
1 1 1   28   14    9 o 24.39792 2.403511   31.75997   349.7   6.074574 1.172814          ?        ? 
1 1 1   28   14   10 o 11.11262 4.141999   26.48866    42.9   1.082597 1.232958          ?        ? 
1 1 1   28   14   11 o 13.21166 3.990321   15.28633   146.4   1.924617 1.142741          ?        ? 
1 1 1   28   14   12 o 10.49298 4.044171   7.654450   141.1  0.9322364 1.202886          ?        ? 
1 1 1   28   14   13 o 31.90205 1.979543   47.68095   350.0   10.46511 1.263030          ?        ? 
1 1 1   28   14   14 f 24.18426 3.232995   30.85450   320.3   6.405366 1.563751          ?        ? 
1 1 1   28   14   15 o 16.03721 4.622012   18.28659   117.2   3.368080 1.563751          ?        ? 
1 1 1   28   15    0 o 6.167511 4.210702   13.72059   180.0 -0.7217315 1.533679 -0.7217315 1.533679 
1 1 1   28   15    1 o 53.30209 1.241203   64.59317   235.8   28.47832 1.323174          ?        ? 
1 1 1   28   15    2 o 48.08194 1.344686   60.91843    92.1   23.18562 1.293102          ?        ? 
1 1 1   28   15    3 o 21.95623 2.396871   39.95382    30.5   4.871688 1.052525          ?        ? 
1 1 1   28   15    4 o 32.60601 1.383432   57.97654   224.3   10.67561 0.9021643          ?        ? 
1 1 1   28   15    5 o 7.851167 3.292471   9.752987    88.2  0.1202886 0.8720922          ?        ? 
1 1 1   28   15    6 o 15.33890 2.746002   18.94521   212.6   2.465916 0.8119479          ?        ? 
1 1 1   28   15    7 o 37.67286 1.237279   40.14365   167.0   14.25420 0.9322364          ?        ? 
1 1 1   28   15    8 o 42.47232 1.062062   58.50369    67.7   18.10343 0.9021643          ?        ? 
1 1 1   28   15    9 o 10.30704 4.065753   13.56603    28.1  0.7217315 1.232958          ?        ? 
1 1 1   28   15   10 o 16.77180 3.921255   35.09634   209.4   3.127503 1.293102          ?        ? 
1 1 1   28   15   11 o 12.05250 4.180775   27.06969    85.7   1.503607 1.232958          ?        ? 
1 1 1   28   15   12 o 8.918314 3.833437   12.38850    24.5  0.1202886 1.232958          ?        ? 
1 1 1   28   15   13 o 9.852777 4.061860   15.50494   210.2  0.6014429 1.293102          ?        ? 
1 1 1   28   15   14 o 11.45979 4.020127   16.92696   148.6   1.473535 1.142741          ?        ? 
1 1 1   28   15   15 o 15.37442 4.618591   25.84209   335.3   3.127503 1.533679          ?        ? 
1 1 1   28   16    0 o 33.06957 2.671126   52.34829   180.0   11.21691 1.744184   11.21691 1.744184 
1 1 1   28   16    1 o 47.26178 1.272578   64.52614    21.8   22.40375 1.202886          ?        ? 
1 1 1   28   16    2 o 22.23093 2.231982   36.53532   309.5   4.991976 0.9923807          ?        ? 
1 1 1   28   16    3 o 20.52551 2.490688   38.23230   348.5   4.270245 1.022453          ?        ? 
1 1 1   28   16    4 o 29.09464 1.550396   49.83158   129.5   8.510417 0.9021643          ?        ? 
1 1 1   28   16    5 o 45.04847 1.168214   54.99576   240.5   20.35884 1.052525          ?        ? 
1 1 1   28   16    6 o 34.54762 1.392728   52.66183   176.9   11.99879 0.9623086          ?        ? 
1 1 1   28   16    7 o 22.48538 1.939243   39.78632   292.3   5.112265 0.8720922          ?        ? 
1 1 1   28   16    8 o 42.31660 1.101502   64.23695   267.3   17.98314 0.9322364          ?        ? 
1 1 1   28   16    9 o 26.00271 2.428651   35.14878   212.2   6.916593 1.263030          ?        ? 
1 1 1   28   16   10 o 25.80994 2.563304   28.22107   125.3   6.886521 1.323174          ?        ? 
1 1 1   28   16   11 o 32.23028 2.006036   44.62351   252.2   10.64554 1.293102          ?        ? 
1 1 1   28   16   12 f 23.89560 2.705733   33.32360   172.8   5.984357 1.293102          ?        ? 
1 1 1   28   16   13 o 11.61783 4.211119   19.36062   252.7   1.443463 1.263030          ?        ? 
1 1 1   28   16   14 o 11.46275 4.114086   13.71055   166.2   1.503607 1.202886          ?        ? 
1 1 1   28   17    0 o 31.59148 2.456618   75.12507     0.0   10.22453 1.533679   10.22453 1.533679 
1 1 1   28   17    1 o 15.26518 3.160243   21.37653    52.5   2.465916 0.9322364          ?        ? 
1 1 1   28   17    2 o 14.74151 3.427776   11.39947   253.0   2.315555 0.9923807          ?        ? 
1 1 1   28   17    3 o 20.83697 2.236977   34.80355   244.6   4.390533 0.9322364          ?        ? 
1 1 1   28   17    4 o 46.32384 1.200968   70.49693   105.2   21.53165 1.112669          ?        ? 
1 1 1   28   17    5 o 8.043688 3.327666   18.46405   302.1  0.2105050 0.8720922          ?        ? 
1 1 1   28   17    6 o 21.53197 2.025110   31.16230   331.2   4.691255 0.8720922          ?        ? 
1 1 1   28   17    7 o 36.64954 1.271826   52.99181   316.8   13.50239 0.9322364          ?        ? 
1 1 1   28   17    8 o 7.520669 3.098230   20.87056   270.3  0.2105050 0.7518036          ?        ? 
1 1 1   28   17    9 o 5.532195 2.623195   9.753092   191.9 -0.9021643 0.7818757          ?        ? 
1 1 1   28   17   10 o 15.35556 3.982050   23.32408   172.7   2.646349 1.232958          ?        ? 
1 1 1   28   17   11 o 27.90512 2.370845   38.42952   140.9   8.059335 1.323174          ?        ? 
1 1 1   28   17   12 o 21.34263 2.958936   22.75147   224.7   4.841615 1.263030          ?        ? 
1 1 1   28   17   13 o 9.890109 4.066953   15.30661   193.7  0.6615872 1.293102          ?        ? 
1 1 1   28   17   14 o 8.930516 3.859853   12.42624   349.4  0.3007214 1.263030          ?        ? 
1 1 1   28   18    0 o 13.13224 5.807376   40.09740    -0.0   2.556132 1.593824   2.556132 1.593824 
1 1 1   28   18    1 o 11.60583 3.624324   25.32497   157.0   1.383319 0.9322364          ?        ? 
1 1 1   28   18    2 o 32.10560 1.685995   57.83954     9.4   10.37489 1.082597          ?        ? 
1 1 1   28   18    3 o 55.64503 1.161921   74.00333   101.3   31.06453 1.293102          ?        ? 
1 1 1   28   18    4 o 31.49936 1.527505   50.04381    48.3   9.983953 0.9623086          ?        ? 
1 1 1   28   18    5 o 35.68708 1.432525   55.20708    89.6   12.81073 1.022453          ?        ? 
1 1 1   28   18    6 o 21.23152 2.124587   28.20882     1.2   4.570966 0.9021643          ?        ? 
1 1 1   28   18    7 o 11.95877 3.292331   20.92984   101.8   1.533679 0.8119479          ?        ? 
1 1 1   28   18    8 o 47.43900 1.109346   66.86481    26.0   22.61425 1.052525          ?        ? 
1 1 1   28   18    9 o 8.390307 3.107255   9.997928   116.1  0.6014429 0.6916593          ?        ? 
1 1 1   28   18   10 f 7.636215 3.541477   9.002060   234.1 -0.9021643 1.293102          ?        ? 
1 1 1   28   18   11 o 17.44379 3.811577   26.90031   165.6   3.428224 1.293102          ?        ? 
1 1 1   28   18   12 o 19.74974 3.273720   25.93414   161.9   4.240172 1.293102          ?        ? 
1 1 1   28   18   13 o 7.196082 3.317303   11.09386   161.6 -0.6014429 1.112669          ?        ? 
1 1 1   28   18   14 f 6.951674 3.266617   9.322366   254.0 -0.8720922 1.172814          ?        ? 
1 1 1   28   19    0 o 44.95043 1.981863   47.62930   360.0   20.41899 1.774257   20.41899 1.774257 
1 1 1   28   19    1 o 30.78616 1.904774   44.81771   233.6   9.562942 1.172814          ?        ? 
1 1 1   28   19    2 o 35.18265 1.495801   42.91122    67.1   12.44987 1.052525          ?        ? 
1 1 1   28   19    3 o 33.74205 1.515102   57.42192   116.5   11.45749 1.022453          ?        ? 
1 1 1   28   19    4 o 31.38927 1.580764   46.31750   312.0   9.923808 0.9923807          ?        ? 
1 1 1   28   19    5 o 23.70914 1.902567   24.33040   195.7   5.683635 0.9021643          ?        ? 
1 1 1   28   19    6 o 18.48546 2.440200   27.15978   207.5   3.488369 0.9021643          ?        ? 
1 1 1   28   19    7 o 43.33832 1.214312   43.16408   262.3   18.88531 1.052525          ?        ? 
1 1 1   28   19    8 o 9.458698 3.266213   15.43550   164.8  0.8720922 0.7518036          ?        ? 
1 1 1   28   19    9 o 20.11386 1.868869   28.14624    87.4   4.119884 0.7518036          ?        ? 
1 1 1   28   19   10 o 18.98192 3.777836   29.02750    64.6   4.029667 1.383319          ?        ? 
1 1 1   28   19   11 o 15.10292 4.219531   11.94614   142.2   2.646349 1.323174          ?        ? 
1 1 1   28   19   12 o 20.74415 3.334238   28.04302    36.9   4.721327 1.383319          ?        ? 
1 1 1   28   19   13 o 9.167562 3.956346   14.54087   290.3  0.3307936 1.323174          ?        ? 
1 1 1   28   20    0 o 35.75825 2.074986   39.51627   180.0   12.99117 1.473535   12.99117 1.473535 
1 1 1   28   20    1 o 33.46497 1.572577   49.36080   190.3   11.27705 1.052525          ?        ? 
1 1 1   28   20    2 o 26.46655 1.761160   37.70466   329.3   7.066954 0.9322364          ?        ? 
1 1 1   28   20    3 o 36.68235 1.393658   44.49061   275.6   13.53246 1.022453          ?        ? 
1 1 1   28   20    4 o 5.523165 2.661281   12.63502   168.5  -1.293102 0.8720922          ?        ? 
1 1 1   28   20    5 o 15.93059 3.131911   26.00644   295.5   2.706493 0.9623086          ?        ? 
1 1 1   28   20    6 o 37.41868 1.406417   40.92279   267.4   14.10384 1.052525          ?        ? 
1 1 1   28   20    7 o 27.46375 1.697212   39.24104    50.1   7.638325 0.9322364          ?        ? 
1 1 1   28   20    8 o 6.420931 2.891807   5.018308    84.4 -0.3307936 0.7818757          ?        ? 
1 1 1   28   20    9 f 8.345889 3.155970   17.30869     8.6  0.5713707 0.7217315          ?        ? 
1 1 1   28   20   10 o 11.16357 4.223513   13.84758   116.1   1.142741 1.293102          ?        ? 
1 1 1   28   20   11 o 18.12260 3.927190   26.71519   329.0   3.789090 1.383319          ?        ? 
1 1 1   28   20   12 o 7.780357 3.564973   5.086500   202.5 -0.5713707 1.263030          ?        ? 
1 1 1   28   20   13 o 11.21488 4.297793   17.47481   100.4   1.383319 1.353247          ?        ? 
1 1 1   28   21    0 o 40.44414 1.679244   50.50926   180.0   16.50961 1.353247   16.50961 1.353247 
1 1 1   28   21    1 o 21.38600 2.531088   25.64908   132.5   4.661182 1.082597          ?        ? 
1 1 1   28   21    2 o 53.32920 1.212377   78.05875   234.9   28.56854 1.293102          ?        ? 
1 1 1   28   21    3 o 24.15362 2.178815   40.78713    24.3   5.924213 1.052525          ?        ? 
1 1 1   28   21    4 o 41.20320 1.313729   36.59127   250.4   17.08098 1.082597          ?        ? 
1 1 1   28   21    5 o 10.82941 3.640028   13.08578   246.3   1.172814 0.9322364          ?        ? 
1 1 1   28   21    6 o 19.60113 2.454727   23.10027    65.8   3.939451 0.9623086          ?        ? 
1 1 1   28   21    7 o 19.58480 2.303226   31.78921   113.6   3.939451 0.9021643          ?        ? 
1 1 1   28   21    8 o 29.43146 1.583741   34.77319   122.4   8.781067 0.9322364          ?        ? 
1 1 1   28   21    9 o 22.43243 1.876791   34.56598   229.5   5.142337 0.8420200          ?        ? 
1 1 1   28   21   10 o 20.77291 1.592428   31.45508   194.5   4.390533 0.6615872          ?        ? 
1 1 1   28   21   11 o 10.15477 4.076889   32.54079   271.8  0.8119479 1.263030          ?        ? 
1 1 1   28   21   12 o 13.11156 4.385609   19.22994    21.7   2.105050 1.353247          ?        ? 
1 1 1   28   21   13 o 7.041193 3.336494   13.85469   114.1  -1.052525 1.263030          ?        ? 
1 1 1   28   22    0 f 12.43960 5.067895   24.61356   360.0   2.225339 1.232958   2.225339 1.232958 
1 1 1   28   22    1 o 21.54653 2.233094   26.21598   263.3   4.721327 0.9623086          ?        ? 
1 1 1   28   22    2 o 7.663676 3.341267   22.07821   100.5 -0.1202886 0.9623086          ?        ? 
1 1 1   28   22    3 o 14.46273 3.295288   23.62429   281.5   2.255411 0.9322364          ?        ? 
1 1 1   28   22    4 o 20.87846 2.376566   46.31752   274.3   4.450677 0.9923807          ?        ? 
1 1 1   28   22    5 o 47.05835 1.214175   60.94135   346.2   22.28346 1.142741          ?        ? 
1 1 1   28   22    6 o 36.40061 1.404445   42.48668   307.2   13.38210 1.022453          ?        ? 
1 1 1   28   22    7 o 25.93576 1.913152   31.48269   276.1   6.856449 0.9923807          ?        ? 
1 1 1   28   22    8 o 20.42660 2.208307   27.38713   263.5   4.300317 0.9021643          ?        ? 
1 1 1   28   22    9 o 9.245416 3.317019   9.628778    58.5  0.8119479 0.7818757          ?        ? 
1 1 1   28   22   10 o 6.880600 2.944389   13.63131   291.0       0.06 0.7217315          ?        ? 
1 1 1   28   22   11 o 27.33065 2.695756   32.22641   259.9   7.969118 1.473535          ?        ? 
1 1 1   28   22   12 o 21.01431 3.219821   36.97358   350.9   4.961904 1.353247          ?        ? 
1 1 1   28   23    0 o 19.39688 4.150710   18.00837   180.0   4.330389 1.413391   4.330389 1.413391 
1 1 1   28   23    1 o 17.88227 2.606594   33.05614   332.1   3.277864 0.9322364          ?        ? 
1 1 1   28   23    2 o 19.98157 2.558491   32.43147   150.2   4.089812 1.022453          ?        ? 
1 1 1   28   23    3 o 56.00563 1.208134   68.43985   214.0   31.54568 1.353247          ?        ? 
1 1 1   28   23    4 o 26.20186 1.893722   35.49691   226.5   6.976738 0.9923807          ?        ? 
1 1 1   28   23    5 o 23.00892 2.352560   23.55143    49.6   5.443058 1.082597          ?        ? 
1 1 1   28   23    6 o 32.89803 1.645383   38.49170    46.9   10.97633 1.082597          ?        ? 
1 1 1   28   23    7 o 21.90290 2.128112   23.38506   330.7   4.931832 0.9322364          ?        ? 
1 1 1   28   23    8 o 17.89570 2.604639   23.26097    49.0   3.338008 0.9322364          ?        ? 
1 1 1   28   23    9 o 36.19743 1.412328   58.87037    42.0   13.29189 1.022453          ?        ? 
1 1 1   28   23   10 o 13.00804 3.054231   21.18701    60.2   1.894545 0.7818757          ?        ? 
1 1 1   28   23   11 f 9.631271 3.135362   12.27080   313.8   1.022453 0.6916593          ?        ? 
1 1 1   28   23   12 f 16.72095 4.077540   25.36154   339.0   3.488369 1.353247          ?        ? 
1 1 1   28   24    0 o 22.41181 2.752003   7.012013   180.0   5.322770 1.202886   5.322770 1.202886 
1 1 1   28   24    1 o 17.33315 2.689172   10.03747     2.6   3.097431 0.9322364          ?        ? 
1 1 1   28   24    2 o 13.37070 3.460310   21.61827   228.7   1.954689 0.9322364          ?        ? 
1 1 1   28   24    3 o 24.11964 2.181884   30.50982   200.4   5.954284 1.052525          ?        ? 
1 1 1   28   24    4 o 43.90843 1.335522   53.85773   290.8   19.45668 1.172814          ?        ? 
1 1 1   28   24    5 o 20.30713 2.591517   31.43225   285.8   4.270245 1.052525          ?        ? 
1 1 1   28   24    6 o 11.54692 3.693195   19.90848   165.6   1.443463 0.9623086          ?        ? 
1 1 1   28   24    7 o 36.66039 1.599565   38.70805   127.1   13.65275 1.172814          ?        ? 
1 1 1   28   24    8 o 8.408763 3.454694   18.18730     1.9  0.3608657 0.9322364          ?        ? 
1 1 1   28   24    9 o 12.06425 3.596143   8.012188   174.2   1.653968 0.9322364          ?        ? 
1 1 1   28   24   10 o 13.74894 3.131186   25.87088   149.7   2.135122 0.8420200          ?        ? 
1 1 1   28   24   11 f 24.27239 1.610628   29.26405   193.9   6.074574 0.7818757          ?        ? 
1 1 1   28   25    0 o 18.24851 4.577887   24.78675    -0.0   4.029667 1.443463   4.029667 1.443463 
1 1 1   28   25    1 o 35.33905 1.489181   48.62506    52.1   12.63030 1.052525          ?        ? 
1 1 1   28   25    2 o 27.57073 1.799700   34.65320    56.1   7.728541 0.9923807          ?        ? 
1 1 1   28   25    3 o 15.37703 3.321154   11.11462    76.8   2.586205 0.9923807          ?        ? 
1 1 1   28   25    4 o 7.711020 3.419228   10.26192   176.5 -0.2405772 1.052525          ?        ? 
1 1 1   28   25    5 o 12.91852 3.814329   24.26713   349.1   1.864473 1.052525          ?        ? 
1 1 1   28   25    6 o 17.84816 2.780065   28.46726    36.6   3.338008 0.9923807          ?        ? 
1 1 1   28   25    7 o 29.84234 1.713091   34.06855   346.8   9.081788 1.022453          ?        ? 
1 1 1   28   25    8 o 30.46008 1.727712   45.15012   265.2   9.502798 1.052525          ?        ? 
1 1 1   28   25    9 f 5.968813 2.845471   8.864573   259.9  -1.022453 0.9322364          ?        ? 
1 1 1   28   25   10 o 27.53650 1.747333   31.40187   154.5   7.848830 0.9623086          ?        ? 
1 1 1   28   25   11 o 14.02393 2.984062   11.67808   174.2   2.255411 0.8119479          ?        ? 
1 1 1   28   26    0 o 19.54692 4.106110   28.34752    -0.0   4.420605 1.413391   4.420605 1.413391 
1 1 1   28   26    1 o 18.11142 2.573615   30.99195   108.3   3.398152 0.9322364          ?        ? 
1 1 1   28   26    2 o 33.10120 1.499010   33.71603   125.0   11.09662 0.9923807          ?        ? 
1 1 1   28   26    3 o 11.57378 3.755351   3.874004   333.9   1.443463 0.9923807          ?        ? 
1 1 1   28   26    4 o 6.956104 3.095742   8.671770   236.0 -0.2405772 0.8720922          ?        ? 
1 1 1   28   26    5 o 32.28392 1.723257   41.77077     2.9   10.61547 1.112669          ?        ? 
1 1 1   28   26    6 o 18.11420 2.822242   17.79773    18.5   3.458297 1.022453          ?        ? 
1 1 1   28   26    7 o 9.182128 3.707025   11.27742    89.5  0.5713707 1.052525          ?        ? 
1 1 1   28   26    8 o 28.22054 1.864821   32.70144    97.4   8.209695 1.052525          ?        ? 
1 1 1   28   26    9 o 12.20480 3.585365   13.31691    26.0   1.744184 0.9322364          ?        ? 
1 1 1   28   26   10 o 10.31673 3.733422   13.22560    10.5   1.172814 0.9923807          ?        ? 
1 1 1   28   27    0 o 12.26412 5.410294   19.50391   180.0   2.315555 1.383319   2.315555 1.383319 
1 1 1   28   27    1 o 20.13828 2.463916   18.64436   152.4   4.210100 0.9923807          ?        ? 
1 1 1   28   27    2 o 10.48174 3.739309   17.10306   256.5   1.082597 0.9923807          ?        ? 
1 1 1   28   27    3 o 17.78892 2.704798   24.02164    58.1   3.307936 0.9623086          ?        ? 
1 1 1   28   27    4 o 8.426798 3.521797   14.59698   292.9  0.2706493 0.9923807          ?        ? 
1 1 1   28   27    5 o 15.62198 3.280579   11.25896   359.4   2.706493 0.9923807          ?        ? 
1 1 1   28   27    6 o 10.31869 3.784098   7.486465    86.2   1.052525 1.022453          ?        ? 
1 1 1   28   27    7 o 8.081038 3.508521   24.96125    18.9       0.06 1.052525          ?        ? 
1 1 1   28   27    8 o 7.706314 3.376151   10.96268   101.9   0.000000 0.9923807          ?        ? 
1 1 1   28   27    9 o 10.61692 3.794741   11.25314    33.9   1.263030 1.022453          ?        ? 
1 1 1   28   28    0 o 30.94829 2.409393   45.03999    -0.0   9.923808 1.473535   9.923808 1.473535 
1 1 1   28   28    1 o 56.92793 1.162149   71.32285   340.3   32.68842 1.323174          ?        ? 
1 1 1   28   28    2 o 13.86734 3.640290   6.865884   193.4   2.165194 1.022453          ?        ? 
1 1 1   28   28    3 o 22.14074 2.308986   26.70906   196.6   5.082192 1.022453          ?        ? 
1 1 1   28   28    4 o 16.48007 3.033233   13.97745   135.8   2.977142 0.9623086          ?        ? 
1 1 1   28   28    5 o 12.36962 3.569908   19.41257    39.1   1.744184 0.9322364          ?        ? 
1 1 1   28   28    6 o 11.64193 3.753163   16.89124   250.4   1.533679 0.9923807          ?        ? 
1 1 1   28   28    7 o 17.09167 3.105710   26.98859    99.4   3.277864 1.022453          ?        ? 
1 1 1   28   28    8 o 14.05258 3.847636   19.65659   245.6   2.405771 1.112669          ?        ? 
1 1 1   28   28    9 o 24.40044 2.156775   37.57492   338.9   6.315150 1.052525          ?        ? 
1 1 1   28   29    0 o 5.263776 3.730619   12.40733    -0.0  -1.413391 1.503607  -1.413391 1.503607 
1 1 1   28   29    1 o 30.90830 1.751305   33.88206    93.9   9.773447 1.082597          ?        ? 
1 1 1   28   29    2 o 30.72593 1.810636   42.60676   348.7   9.683230 1.112669          ?        ? 
1 1 1   28   29    3 o 9.217563 3.603811   18.57259   342.0  0.6916593 0.9623086          ?        ? 
1 1 1   28   29    4 o 28.59863 1.840167   38.10474   322.3   8.420200 1.052525          ?        ? 
1 1 1   28   29    5 o 8.138132 3.494237   13.91135   172.3  0.1503607 1.022453          ?        ? 
1 1 1   28   29    6 o 21.01849 2.432271   25.15909   128.0   4.691255 1.022453          ?        ? 
1 1 1   28   29    7 o 12.53832 3.771963   31.71986   120.4   1.894545 1.022453          ?        ? 
1 1 1   28   29    8 o 17.71624 3.262531   22.37285   172.2   3.638730 1.112669          ?        ? 
1 1 1   28   30    0 o 39.08928 1.933366   53.20079     0.0   15.63752 1.503607   15.63752 1.503607 
1 1 1   28   30    1 o 6.407242 3.067329   13.17620   191.4  -1.293102 1.112669          ?        ? 
1 1 1   28   30    2 o 7.072177 3.195376   4.361080   315.2 -0.3307936 0.9623086          ?        ? 
1 1 1   28   30    3 o 14.88102 3.575672   18.37453    16.1   2.556132 1.052525          ?        ? 
1 1 1   28   30    4 o 7.670094 3.368102   7.226167   217.1      -0.03 0.9923807          ?        ? 
1 1 1   28   30    5 o 12.12510 3.729986   18.95748   113.6   1.744184 0.9923807          ?        ? 
1 1 1   28   30    6 o 9.880139 3.750414   11.17902    69.1  0.9923807 1.022453          ?        ? 
1 1 1   28   30    7 o 22.39323 2.282951   34.30332   168.5   5.352841 1.022453          ?        ? 
1 1 1   28   31    0 o 7.165270 4.614841   16.93802   180.0  0.3608657 1.473535  0.3608657 1.473535 
1 1 1   28   31    1 o 6.814943 3.156190   13.75157   229.0 -0.6315150 1.022453          ?        ? 
1 1 1   28   31    2 o 27.73702 1.951538   38.05567   161.1   7.999191 1.082597          ?        ? 
1 1 1   28   31    3 o 12.59137 4.236904   16.17669   184.6   1.924617 1.263030          ?        ? 
1 1 1   28   31    4 o 9.350055 3.890553   8.513517   276.4  0.6014429 1.202886          ?        ? 
1 1 1   28   31    5 o 13.62181 4.089930   24.34294   356.6   2.315555 1.202886          ?        ? 
1 1 1   28   31    6 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   28   32    0 o 4.482114 3.252886   2.826733   180.0  -2.225339 1.443463  -2.225339 1.443463 
1 1 1   28   32    1 o 13.36734 4.166835   9.447514   198.0   2.225339 1.232958          ?        ? 
1 1 1   28   32    2 o 9.773033 3.926530   7.055537   321.6  0.8420200 1.172814          ?        ? 
1 1 1   28   32    3 o 10.54783 4.127707   14.84518   132.2   1.142741 1.263030          ?        ? 
1 1 1   28   32    4 o 12.94091 4.128115   16.92471    46.7   2.105050 1.202886          ?        ? 
1 1 1   28   33    0 o 7.937388 5.187010   5.689896   180.0  0.5112265 1.954689  0.5112265 1.954689 
1 1 1   28   33    1 o 16.27141 4.600491   15.90681     6.6   3.518441 1.563751          ?        ? 
1 1 1   29    0    1 o 47.81574 1.607723   29.13813   270.0   22.97512 1.533679   22.97512 1.533679 
1 1 1   29    0    2 o 16.16223 4.816713   7.663081    90.0   3.247792 1.353247   3.247792 1.353247 
1 1 1   29    0    3 o 6.607096 4.297412   3.404455    90.0   0.000000 1.323174   0.000000 1.323174 
1 1 1   29    0    4 o 11.01011 5.159492   11.38477   270.0   1.804329 1.263030   1.804329 1.263030 
1 1 1   29    0    5 o 10.47730 5.370669  0.9114798    90.0   1.653968 1.413391   1.653968 1.413391 
1 1 1   29    0    6 o 39.68552 1.750178   98.74809    90.0   15.87809 1.383319   15.87809 1.383319 
1 1 1   29    0    7 o 11.02993 5.215899   9.132570   270.0   1.834401 1.293102   1.834401 1.293102 
1 1 1   29    0    8 o 16.90044 3.888907   17.19779   270.0   3.307936 1.142741   3.307936 1.142741 
1 1 1   29    0    9 o 9.003737 4.524955   28.32475   270.0   1.232958 0.9923807   1.232958 0.9923807 
1 1 1   29    0   10 o 8.661898 4.433445   10.71196    90.0   1.142741 0.9623086   1.142741 0.9623086 
1 1 1   29    0   11 o 9.636315 6.273132   13.65417    90.0  0.3007214 2.826782  0.3007214 2.826782 
1 1 1   29    0   12 o 13.00536 7.416688   13.84118   270.0   2.796710 2.977142   2.796710 2.977142 
1 1 1   29    0   13 o 8.280128 5.661895  0.2097644    90.0 -0.8420200 2.796710 -0.8420200 2.796710 
1 1 1   29    0   14 o 6.385289 4.407156   17.67924    90.0 -0.8420200 1.774257 -0.8420200 1.774257 
1 1 1   29    0   15 o 11.06303 6.559460   17.32923    90.0   2.105050 2.465916   2.105050 2.465916 
1 1 1   29    0   16 o 8.185729 5.491004   14.46844    90.0  0.1503607 2.435844  0.1503607 2.435844 
1 1 1   29    1    0 o 5.793562 3.878383   13.61463     0.0 -0.3307936 1.202886 -0.3307936 1.202886 
1 1 1   29    1    1 o 30.14642 1.496305   41.34382   218.1   9.111859 0.9021643          ?        ? 
1 1 1   29    1    2 f 12.69420 3.540189   25.51460   310.0   1.684040 0.9322364          ?        ? 
1 1 1   29    1    3 o 49.22670 1.099604   69.31717    43.8   24.26822 1.082597          ?        ? 
1 1 1   29    1    4 o 71.03681 0.9736633   88.40675    22.7   50.52120 1.383319          ?        ? 
1 1 1   29    1    5 o 22.27398 2.025152   36.02914   323.2   4.991976 0.9021643          ?        ? 
1 1 1   29    1    6 o 51.25203 1.056151   87.94034   249.4   26.31313 1.082597          ?        ? 
1 1 1   29    1    7 o 8.535741 3.315817   11.34064    61.1  0.4811543 0.8119479          ?        ? 
1 1 1   29    1    8 o 13.37019 2.998321   19.69816    19.7   1.894545 0.7818757          ?        ? 
1 1 1   29    1    9 o 26.95890 1.394351   46.13907    26.4   7.307531 0.7518036          ?        ? 
1 1 1   29    1   10 o 21.74379 1.867080   36.46344   250.9   4.781471 0.8119479          ?        ? 
1 1 1   29    1   11 o 32.47477 3.611461   44.77612   159.5   11.06655 2.345627          ?        ? 
1 1 1   29    1   12 o 23.55318 4.826471   34.37135    91.6   6.375295 2.195267          ?        ? 
1 1 1   29    1   13 o 11.91559 4.835867   18.34009    88.9   1.052525 1.804329          ?        ? 
1 1 1   29    1   14 o 13.24104 5.082045   19.05987   139.0   1.804329 1.894545          ?        ? 
1 1 1   29    1   15 o 17.78858 4.273387   20.51677   281.4   3.819162 1.503607          ?        ? 
1 1 1   29    1   16 o 9.780736 4.399624   9.078198   247.4       0.09 1.804329          ?        ? 
1 1 1   29    2    0 o 43.95409 1.612539   61.17017   360.0   19.42661 1.413391   19.42661 1.413391 
1 1 1   29    2    1 o 64.44986 1.026515   89.89279   119.3   41.58978 1.323174          ?        ? 
1 1 1   29    2    2 o 24.77534 1.881380   29.98097   224.3   6.164790 0.9322364          ?        ? 
1 1 1   29    2    3 o 42.97050 1.154723   65.56651   262.8   18.49437 0.9923807          ?        ? 
1 1 1   29    2    4 o 11.71659 3.686999   20.24567   165.0   1.383319 0.9623086          ?        ? 
1 1 1   29    2    5 o 25.41721 1.893026   37.06865   110.5   6.495584 0.9623086          ?        ? 
1 1 1   29    2    6 o 39.82418 1.396977   70.55699   190.6   15.90816 1.112669          ?        ? 
1 1 1   29    2    7 o 14.43651 2.914226   20.17975   291.3   2.195267 0.8119479          ?        ? 
1 1 1   29    2    8 o 26.99546 1.726654   49.58639    26.3   7.337603 0.9322364          ?        ? 
1 1 1   29    2    9 o 18.73961 1.925684   19.47826    65.8   3.548513 0.7217315          ?        ? 
1 1 1   29    2   10 o 8.348910 3.338362   18.20793   238.6  0.3909379 0.8420200          ?        ? 
1 1 1   29    2   11 o 26.93661 2.009527   36.30188   337.9   7.367675 1.082597          ?        ? 
1 1 1   29    2   12 o 18.81193 4.905390   21.12230   317.6   4.119884 1.864473          ?        ? 
1 1 1   29    2   13 o 40.93541 2.497723   52.02644    46.5   17.41177 2.044906          ?        ? 
1 1 1   29    2   14 o 19.92817 4.677678   25.14412   312.6   4.751399 1.834401          ?        ? 
1 1 1   29    2   15 o 11.35440 4.768997   16.35789   301.4  0.9322364 1.834401          ?        ? 
1 1 1   29    2   16 o 12.95556 4.872856   14.68141    63.4   2.135122 1.714112          ?        ? 
1 1 1   29    3    0 o 47.76081 1.546179   67.08323     0.0   22.91497 1.473535   22.91497 1.473535 
1 1 1   29    3    1 o 27.08517 1.887478   37.46799   169.5   7.367675 1.022453          ?        ? 
1 1 1   29    3    2 o 34.02594 1.458271   52.08060   252.0   11.60785 0.9923807          ?        ? 
1 1 1   29    3    3 o 22.88711 1.970901   23.77172   245.1   5.262625 0.9021643          ?        ? 
1 1 1   29    3    4 o 20.74243 2.247173   27.64153   119.3   4.330389 0.9322364          ?        ? 
1 1 1   29    3    5 o 18.43086 2.447428   18.96833   148.1   3.428224 0.9021643          ?        ? 
1 1 1   29    3    6 o 59.03617 1.044240   86.36213   241.7   34.91376 1.232958          ?        ? 
1 1 1   29    3    7 o 8.431288 3.386552   20.28288    53.5  0.3608657 0.8720922          ?        ? 
1 1 1   29    3    8 o 31.65474 1.520007   53.92643   265.2   10.07417 0.9623086          ?        ? 
1 1 1   29    3    9 o 33.42667 1.169539   48.86573    88.7   11.21691 0.7818757          ?        ? 
1 1 1   29    3   10 o 24.57879 1.774075   37.83036   256.3   6.104645 0.8720922          ?        ? 
1 1 1   29    3   11 o 29.78587 1.312494   47.33958   338.3   8.931427 0.7818757          ?        ? 
1 1 1   29    3   12 f 15.86246 3.240117   29.07234     2.3   2.736565 0.9923807          ?        ? 
1 1 1   29    3   13 o 11.87003 4.756113   9.040139    81.6   1.112669 1.714112          ?        ? 
1 1 1   29    3   14 f 16.86409 4.998153   16.80065   164.4   3.488369 1.804329          ?        ? 
1 1 1   29    3   15 o 18.40568 4.954626   33.45752    60.2   4.330389 1.864473          ?        ? 
1 1 1   29    3   16 o 8.766342 3.975736   11.89587    77.5 -0.1804329 1.503607          ?        ? 
1 1 1   29    4    0 o 7.247314 4.558993   18.49665   180.0  0.3307936 1.353247  0.3307936 1.353247 
1 1 1   29    4    1 o 12.79654 3.529904   36.59805    69.3   1.714112 0.9322364          ?        ? 
1 1 1   29    4    2 o 53.60899 1.065811   81.52888   326.5   28.77904 1.142741          ?        ? 
1 1 1   29    4    3 o 27.85846 1.727139   37.19136    74.4   7.788685 0.9623086          ?        ? 
1 1 1   29    4    4 o 18.20012 2.395843   21.86398   141.2   3.338008 0.8720922          ?        ? 
1 1 1   29    4    5 o 69.32423 1.084475   105.2094   133.7   48.14550 1.503607          ?        ? 
1 1 1   29    4    6 o 19.43641 2.552891   39.23119   278.6   3.819162 0.9923807          ?        ? 
1 1 1   29    4    7 o 44.48569 1.149193   66.47967   317.4   19.84762 1.022453          ?        ? 
1 1 1   29    4    8 o 43.49371 1.140833   55.79731   306.2   18.97552 0.9923807          ?        ? 
1 1 1   29    4    9 o 21.06141 2.427314   42.13157   183.4   4.510822 1.022453          ?        ? 
1 1 1   29    4   10 o 28.23119 1.810857   45.01810   131.8   8.059335 1.022453          ?        ? 
1 1 1   29    4   11 o 10.32651 3.520653   10.23852   142.9   1.052525 0.8720922          ?        ? 
1 1 1   29    4   12 o 24.24603 2.108495   31.24426   116.4   6.014429 1.022453          ?        ? 
1 1 1   29    4   13 o 7.616870 3.247280   7.026477   332.3       0.09 0.8720922          ?        ? 
1 1 1   29    4   14 o 17.97794 3.954322   28.13823   177.2   3.728946 1.383319          ?        ? 
1 1 1   29    4   15 o 19.12784 5.365232   29.13409   193.0   4.871688 2.135122          ?        ? 
1 1 1   29    4   16 o 8.534333 4.080803   17.15768   126.9  -1.473535 1.954689          ?        ? 
1 1 1   29    5    0 o 64.61292 1.421061   113.9303     0.0   41.86042 1.834401   41.86042 1.834401 
1 1 1   29    5    1 o 22.87864 2.103073   23.92642   348.9   5.262625 0.9623086          ?        ? 
1 1 1   29    5    2 o 7.375648 3.197834   18.93617    52.7 -0.1202886 0.8720922          ?        ? 
1 1 1   29    5    3 o 18.76237 2.564465   27.48494   186.9   3.548513 0.9623086          ?        ? 
1 1 1   29    5    4 o 14.80624 3.417969   22.53178    77.1   2.315555 0.9923807          ?        ? 
1 1 1   29    5    5 o 46.24507 1.300556   74.41457   143.4   21.44144 1.202886          ?        ? 
1 1 1   29    5    6 o 68.88674 1.025880   105.8801   161.3   47.54406 1.413391          ?        ? 
1 1 1   29    5    7 o 8.250435 3.395572   18.98146   261.5  0.2405772 0.9021643          ?        ? 
1 1 1   29    5    8 o 39.59940 1.101143   64.61580    46.6   15.72773 0.8720922          ?        ? 
1 1 1   29    5    9 o 24.00549 2.066987   37.20943   343.9   5.833996 0.9923807          ?        ? 
1 1 1   29    5   10 o 16.42139 2.945288   21.93674   313.5   2.856854 0.9322364          ?        ? 
1 1 1   29    5   11 o 15.76889 2.574524   24.94050     3.8   2.556132 0.8119479          ?        ? 
1 1 1   29    5   12 o 11.47128 3.922611   16.16977   301.4   1.353247 1.082597          ?        ? 
1 1 1   29    5   13 o 7.244779 3.260649   17.41043   349.3 -0.3608657 0.9923807          ?        ? 
1 1 1   29    5   14 o 33.71984 1.516100   44.35793    82.3   11.57778 1.022453          ?        ? 
1 1 1   29    5   15 o 34.79884 1.339465   51.26986   272.4   12.32958 0.9322364          ?        ? 
1 1 1   29    5   16 o 8.800075 4.131445   11.24429   335.8 -0.9021643 1.864473          ?        ? 
1 1 1   29    6    0 o 74.59770 1.614179   104.3210   180.0   55.81390 2.405771   55.81390 2.405771 
1 1 1   29    6    1 o 8.952863 3.637985   33.09817   250.3  0.3307936 1.022453          ?        ? 
1 1 1   29    6    2 o 33.53183 1.569442   46.68786    52.1   11.27705 1.052525          ?        ? 
1 1 1   29    6    3 o 22.34323 2.153468   54.31207    11.5   5.022048 0.9623086          ?        ? 
1 1 1   29    6    4 o 28.84926 1.719941   45.77576   105.8   8.360056 0.9923807          ?        ? 
1 1 1   29    6    5 o 44.02186 1.263769   62.24542    84.2   19.42661 1.112669          ?        ? 
1 1 1   29    6    6 o 30.94254 1.603586   57.32304   124.9   9.623086 0.9923807          ?        ? 
1 1 1   29    6    7 o 35.28194 1.491592   51.54231   276.0   12.51001 1.052525          ?        ? 
1 1 1   29    6    8 o 26.15558 1.609637   30.45793   201.8   6.886521 0.8420200          ?        ? 
1 1 1   29    6    9 o 35.75553 1.513888   54.52951   207.6   12.87088 1.082597          ?        ? 
1 1 1   29    6   10 o 11.90954 3.605516   19.80483   176.6   1.503607 0.9322364          ?        ? 
1 1 1   29    6   11 o 15.49871 3.117062   25.83567    54.2   2.586205 0.9322364          ?        ? 
1 1 1   29    6   12 o 11.76123 3.471837   21.69706    70.8   1.503607 0.8720922          ?        ? 
1 1 1   29    6   13 o 16.33157 3.595642   27.10689   281.8   2.977142 1.142741          ?        ? 
1 1 1   29    6   14 o 10.69063 3.944674   15.50542   106.0   1.142741 1.112669          ?        ? 
1 1 1   29    6   15 o 10.46657 3.789378   7.752201    68.8   1.172814 1.022453          ?        ? 
1 1 1   29    6   16 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   29    7    0 o 42.30034 2.108352   91.90952   180.0   18.07336 1.774257   18.07336 1.774257 
1 1 1   29    7    1 o 19.45733 2.704700   25.55036   294.8   3.819162 1.052525          ?        ? 
1 1 1   29    7    2 o 62.87869 1.171729   97.83012   271.4   39.60501 1.473535          ?        ? 
1 1 1   29    7    3 o 48.55984 1.300488   74.46953    69.1   23.63671 1.263030          ?        ? 
1 1 1   29    7    4 f 26.49395 2.099856   45.12068   306.0   7.066954 1.112669          ?        ? 
1 1 1   29    7    5 o 18.31394 2.873563   28.20591     0.0   3.398152 1.052525          ?        ? 
1 1 1   29    7    6 o 31.73056 1.753309   46.54095   243.3   10.13431 1.112669          ?        ? 
1 1 1   29    7    7 f 47.66232 1.230336   71.32899   146.8   22.79469 1.172814          ?        ? 
1 1 1   29    7    8 o 22.93579 1.507817   40.15118   192.9   5.292697 0.6916593          ?        ? 
1 1 1   29    7    9 o 14.95433 3.480668   31.64211   244.2   2.405771 1.022453          ?        ? 
1 1 1   29    7   10 o 43.32325 1.457682   68.26411   320.1   18.91538 1.263030          ?        ? 
1 1 1   29    7   11 o 32.73487 1.653584   48.68981   241.0   10.85604 1.082597          ?        ? 
1 1 1   29    7   12 o 26.16697 1.838785   35.90031   189.4   6.976738 0.9623086          ?        ? 
1 1 1   29    7   13 o 16.46341 3.657955   28.88862    60.0   3.037287 1.172814          ?        ? 
1 1 1   29    7   14 o 15.97426 3.734180   20.17595   345.9   2.947070 1.172814          ?        ? 
1 1 1   29    7   15 o 8.037808 3.563617   10.72436    52.8      -0.06 1.142741          ?        ? 
1 1 1   29    8    0 o 77.14648 1.482483   123.0279    -0.0   59.66313 2.285483   59.66313 2.285483 
1 1 1   29    8    1 o 43.65119 1.308947   65.91923   190.8   19.09581 1.142741          ?        ? 
1 1 1   29    8    2 o 10.64884 3.745279   21.25894    11.1   1.022453 0.9923807          ?        ? 
1 1 1   29    8    3 o 43.32132 1.423038   65.90724    39.8   18.82516 1.232958          ?        ? 
1 1 1   29    8    4 f 19.53473 2.386100   47.55711   308.6   3.849235 0.9322364          ?        ? 
1 1 1   29    8    5 o 24.77916 2.245172   37.13145   288.3   6.194862 1.112669          ?        ? 
1 1 1   29    8    6 o 26.36100 1.939329   47.13451   252.3   7.006810 1.022453          ?        ? 
1 1 1   29    8    7 o 27.58210 1.853472   32.14165   295.9   7.668397 1.022453          ?        ? 
1 1 1   29    8    8 o 28.85571 1.198479   41.03561   132.0   8.360056 0.6916593          ?        ? 
1 1 1   29    8    9 o 16.27126 3.606950   22.67134   246.7   2.856854 1.142741          ?        ? 
1 1 1   29    8   10 o 11.02989 3.859236   30.90370   133.0   1.172814 1.052525          ?        ? 
1 1 1   29    8   11 o 7.500841 3.323814   13.32731   149.6 -0.2405772 0.9923807          ?        ? 
1 1 1   29    8   12 o 12.94163 3.666752   20.25684   313.8   1.864473 0.9923807          ?        ? 
1 1 1   29    8   13 o 7.430231 3.434339   11.60969   335.4 -0.7818757 1.202886          ?        ? 
1 1 1   29    8   14 o 6.830040 3.278616   20.62847   167.4  -1.533679 1.293102          ?        ? 
1 1 1   29    8   15 o 27.32323 2.476366   34.61944   299.4   7.999191 1.353247          ?        ? 
1 1 1   29    9    0 o 19.69584 4.270643   15.45186   180.0   4.420605 1.473535   4.420605 1.473535 
1 1 1   29    9    1 o 24.38218 2.158390   45.22353   125.8   5.984357 1.052525          ?        ? 
1 1 1   29    9    2 o 57.40208 1.178743   82.64248   284.5   33.01921 1.353247          ?        ? 
1 1 1   29    9    3 o 15.74648 3.347165   18.85446   268.0   2.616277 1.022453          ?        ? 
1 1 1   29    9    4 o 12.13925 3.920705   20.91143   327.6   1.473535 1.082597          ?        ? 
1 1 1   29    9    5 f 30.13165 1.846347   60.52434    76.1   9.141932 1.112669          ?        ? 
1 1 1   29    9    6 o 20.21934 2.602769   20.48893   321.7   4.149956 1.052525          ?        ? 
1 1 1   29    9    7 o 34.85019 1.466926   53.03242   283.3   12.20929 1.022453          ?        ? 
1 1 1   29    9    8 o 24.39263 1.417763   29.58731   314.7   5.984357 0.6916593          ?        ? 
1 1 1   29    9    9 o 10.31190 3.873732   4.337546   327.9  0.8720922 1.082597          ?        ? 
1 1 1   29    9   10 o 13.24951 3.924564   27.15833   278.4   1.894545 1.112669          ?        ? 
1 1 1   29    9   11 o 9.380979 3.771046   10.72528    21.5  0.5412986 1.082597          ?        ? 
1 1 1   29    9   12 o 11.82032 3.922608   21.75521   224.7   1.503607 1.082597          ?        ? 
1 1 1   29    9   13 o 11.80124 4.307006   11.44015   277.2   1.413391 1.323174          ?        ? 
1 1 1   29    9   14 o 18.23453 3.906208   40.59409   272.2   3.879307 1.383319          ?        ? 
1 1 1   29    9   15 o 13.43769 4.434072   23.20679   313.8   2.285483 1.383319          ?        ? 
1 1 1   29   10    0 o 27.26117 2.753466   46.97906   180.0   7.698469 1.473535   7.698469 1.473535 
1 1 1   29   10    1 o 62.79440 1.173301   83.12879   113.1   39.51480 1.473535          ?        ? 
1 1 1   29   10    2 o 22.16840 2.509584   37.38728   199.0   4.961904 1.112669          ?        ? 
1 1 1   29   10    3 o 38.52673 1.365967   55.08255   288.5   14.88571 1.052525          ?        ? 
1 1 1   29   10    4 o 50.33456 1.284508   68.21812     6.9   25.41096 1.293102          ?        ? 
1 1 1   29   10    5 o 37.17244 1.577531   56.71698    33.6   13.89333 1.172814          ?        ? 
1 1 1   29   10    6 o 30.96837 1.699355   38.56176    65.5   9.653158 1.052525          ?        ? 
1 1 1   29   10    7 o 20.84176 2.020031   37.99134    31.6   4.390533 0.8420200          ?        ? 
1 1 1   29   10    8 o 6.610055 2.856627   7.013149   179.0      -0.06 0.6916593          ?        ? 
1 1 1   29   10    9 o 28.16197 2.135656   54.34703   354.0   8.059335 1.202886          ?        ? 
1 1 1   29   10   10 o 7.455991 3.377906   10.41341    51.9 -0.5112265 1.082597          ?        ? 
1 1 1   29   10   11 o 10.56236 3.891819   18.79430    14.0   1.022453 1.082597          ?        ? 
1 1 1   29   10   12 o 7.887384 3.466059   15.00944     1.1 -0.1202886 1.052525          ?        ? 
1 1 1   29   10   13 o 21.94656 2.603465   32.03114   143.2   5.052120 1.142741          ?        ? 
1 1 1   29   10   14 o 7.708088 3.545709   10.27290   343.4 -0.6315150 1.263030          ?        ? 
1 1 1   29   10   15 o 14.54405 4.503495   23.74374   127.1   2.736565 1.443463          ?        ? 
1 1 1   29   11    0 o 8.581073 5.020318   25.07978   360.0  0.9322364 1.413391  0.9322364 1.413391 
1 1 1   29   11    1 o 21.98657 2.256788   28.51842   339.9   4.871688 0.9923807          ?        ? 
1 1 1   29   11    2 o 26.51628 1.814562   50.75020   192.7   7.066954 0.9623086          ?        ? 
1 1 1   29   11    3 o 55.12804 1.172817   72.41572   253.4   30.46308 1.293102          ?        ? 
1 1 1   29   11    4 o 25.44391 1.950135   38.31781    85.2   6.525656 0.9923807          ?        ? 
1 1 1   29   11    5 o 28.76065 1.777520   37.98660   103.0   8.329985 1.022453          ?        ? 
1 1 1   29   11    6 o 59.82697 1.156100   77.05540   175.5   35.90614 1.383319          ?        ? 
1 1 1   29   11    7 o 7.526961 3.134609   10.09626   275.4  0.1503607 0.7818757          ?        ? 
1 1 1   29   11    8 o 18.07664 1.996310   30.00298   217.8   3.307936 0.7217315          ?        ? 
1 1 1   29   11    9 o 13.27157 3.986694   22.96512   237.2   1.894545 1.142741          ?        ? 
1 1 1   29   11   10 o 12.41003 3.911733   15.75663    92.2   1.653968 1.082597          ?        ? 
1 1 1   29   11   11 o 7.835121 3.534511   12.34057   178.5 -0.4510822 1.172814          ?        ? 
1 1 1   29   11   12 o 28.04950 1.983403   40.75779    61.5   8.059335 1.112669          ?        ? 
1 1 1   29   11   13 o 6.438313 3.078634   13.95270   118.1  -1.293102 1.112669          ?        ? 
1 1 1   29   11   14 o 8.800129 3.892781   8.507219   182.8      -0.03 1.353247          ?        ? 
1 1 1   29   11   15 o 17.86783 4.261379   21.02566   237.6   4.029667 1.503607          ?        ? 
1 1 1   29   12    0 o 76.91785 1.604509   128.4202    -0.0   59.36241 2.465916   59.36241 2.465916 
1 1 1   29   12    1 o 49.95470 1.264175   80.55653   233.3   25.02002 1.263030          ?        ? 
1 1 1   29   12    2 o 27.66203 1.848116   38.38242   165.9   7.698469 1.022453          ?        ? 
1 1 1   29   12    3 o 29.78420 1.817402   48.67412   246.7   8.931427 1.082597          ?        ? 
1 1 1   29   12    4 o 35.62179 1.477361   65.26080   347.4   12.75059 1.052525          ?        ? 
1 1 1   29   12    5 f 11.30718 3.755611   29.45614   357.7   1.263030 0.9923807          ?        ? 
1 1 1   29   12    6 o 28.55437 1.632388   47.02603   274.4   8.209695 0.9322364          ?        ? 
1 1 1   29   12    7 o 36.28897 1.284463   48.34077   256.1   13.23174 0.9322364          ?        ? 
1 1 1   29   12    8 o 21.82769 1.722133   32.09486   340.5   4.811543 0.7518036          ?        ? 
1 1 1   29   12    9 o 23.16992 2.595792   33.84158   311.7   5.503202 1.202886          ?        ? 
1 1 1   29   12   10 o 24.88669 2.416725   43.09040    34.3   6.375295 1.202886          ?        ? 
1 1 1   29   12   11 o 24.54661 2.388952   34.97862    30.8   6.224934 1.172814          ?        ? 
1 1 1   29   12   12 o 12.92123 4.071182   5.087823   241.7   1.864473 1.172814          ?        ? 
1 1 1   29   12   13 o 12.54306 4.025852   9.456477     6.5   1.804329 1.142741          ?        ? 
1 1 1   29   12   14 o 9.091138 4.036611   19.55622   137.8   0.000000 1.473535          ?        ? 
1 1 1   29   12   15 o 18.89713 4.242014   32.34546    82.5   4.510822 1.563751          ?        ? 
1 1 1   29   13    0 o 23.07573 2.944310   15.95636   180.0   5.623491 1.323174   5.623491 1.323174 
1 1 1   29   13    1 o 25.85357 1.977392   42.25706   124.6   6.736160 1.022453          ?        ? 
1 1 1   29   13    2 o 8.925177 3.489399   15.12718    74.8  0.5112265 0.9021643          ?        ? 
1 1 1   29   13    3 o 30.76995 1.759179   58.03249   296.9   9.532870 1.082597          ?        ? 
1 1 1   29   13    4 o 43.64465 1.343594   67.21333   333.7   19.12588 1.172814          ?        ? 
1 1 1   29   13    5 o 27.88870 1.940924   52.56685    76.0   7.848830 1.082597          ?        ? 
1 1 1   29   13    6 o 33.40645 1.350284   63.54888     2.4   11.21691 0.9021643          ?        ? 
1 1 1   29   13    7 o 8.843437 3.346443   12.79447    75.8  0.6014429 0.8119479          ?        ? 
1 1 1   29   13    8 o 36.16333 1.164190   55.45942   331.0   13.14153 0.8420200          ?        ? 
1 1 1   29   13    9 o 13.17085 4.117736   17.49930     6.3   1.864473 1.202886          ?        ? 
1 1 1   29   13   10 o 10.17481 4.015145   10.74101    13.7  0.7518036 1.202886          ?        ? 
1 1 1   29   13   11 o 25.65567 2.578717   37.77887   137.2   6.856449 1.323174          ?        ? 
1 1 1   29   13   12 o 10.96791 4.090556   14.51808   317.7   1.142741 1.202886          ?        ? 
1 1 1   29   13   13 o 13.03139 4.125186   16.62992    74.8   1.984761 1.202886          ?        ? 
1 1 1   29   13   14 o 18.67071 4.345743   23.65579   127.6   4.360461 1.593824          ?        ? 
1 1 1   29   14    0 o 72.12227 1.586157   112.7647   180.0   52.23531 2.285483   52.23531 2.285483 
1 1 1   29   14    1 o 22.02400 2.184682   49.12051   183.2   4.901759 0.9623086          ?        ? 
1 1 1   29   14    2 o 33.38301 1.711561   60.45930   184.7   11.21691 1.142741          ?        ? 
1 1 1   29   14    3 f 8.158160 3.411718   8.621709    25.1  0.1503607 0.9322364          ?        ? 
1 1 1   29   14    4 o 39.33697 1.414280   62.99614    37.0   15.54730 1.112669          ?        ? 
1 1 1   29   14    5 o 41.78722 1.223404   59.93129   222.1   17.53206 1.022453          ?        ? 
1 1 1   29   14    6 o 51.93279 1.100212   77.59825   158.5   27.06493 1.142741          ?        ? 
1 1 1   29   14    7 o 15.26787 2.863177   26.18064   184.4   2.465916 0.8420200          ?        ? 
1 1 1   29   14    8 o 36.60229 1.232388   54.47596   210.6   13.47232 0.9021643          ?        ? 
1 1 1   29   14    9 o 21.86960 2.818885   33.40141   134.0   4.961904 1.232958          ?        ? 
1 1 1   29   14   10 o 7.722283 3.531639   14.32059   270.3 -0.6916593 1.232958          ?        ? 
1 1 1   29   14   11 o 33.64260 1.921822   43.19006   281.6   11.57778 1.293102          ?        ? 
1 1 1   29   14   12 o 11.09778 4.054458   13.38217   146.4   1.232958 1.172814          ?        ? 
1 1 1   29   14   13 o 32.36247 2.090765   38.45435    82.7   10.88612 1.353247          ?        ? 
1 1 1   29   14   14 o 12.03358 4.180144   19.61152   238.4   1.744184 1.232958          ?        ? 
1 1 1   29   15    0 o 8.144701 4.902712   10.50146   180.0  0.7518036 1.413391  0.7518036 1.413391 
1 1 1   29   15    1 o 22.94347 2.228200   34.11489   204.1   5.322770 1.022453          ?        ? 
1 1 1   29   15    2 o 42.30912 1.421544   67.04855   246.5   17.98314 1.202886          ?        ? 
1 1 1   29   15    3 o 46.85773 1.283551   78.69897   299.7   22.04288 1.202886          ?        ? 
1 1 1   29   15    4 o 40.58398 1.259676   52.98254   121.7   16.53968 1.022453          ?        ? 
1 1 1   29   15    5 o 37.69543 1.356203   56.27110   169.8   14.28427 1.022453          ?        ? 
1 1 1   29   15    6 o 24.09460 1.809725   32.83924   349.2   5.864068 0.8720922          ?        ? 
1 1 1   29   15    7 o 35.68304 1.306274   59.93408   107.6   12.81073 0.9322364          ?        ? 
1 1 1   29   15    8 o 31.05483 1.355699   39.46141   143.6   9.713303 0.8420200          ?        ? 
1 1 1   29   15    9 o 7.846126 3.537261   10.83199   337.3 -0.4510822 1.172814          ?        ? 
1 1 1   29   15   10 o 24.51622 2.637238   31.36986   259.3   6.255006 1.293102          ?        ? 
1 1 1   29   15   11 o 15.08124 3.943603   19.23438    26.3   2.586205 1.202886          ?        ? 
1 1 1   29   15   12 o 28.43190 2.274034   34.77490    13.0   8.420200 1.293102          ?        ? 
1 1 1   29   15   13 o 9.130976 3.823154   18.10666    47.7  0.4510822 1.172814          ?        ? 
1 1 1   29   15   14 o 11.43399 4.113060   10.06856    68.4   1.533679 1.202886          ?        ? 
1 1 1   29   16    0 f 49.47274 1.767704   77.85605     0.0   24.65916 1.744184   24.65916 1.744184 
1 1 1   29   16    1 o 20.78544 2.604220   44.74728   165.0   4.390533 1.082597          ?        ? 
1 1 1   29   16    2 o 18.18403 2.728715   38.63119   330.8   3.368080 0.9923807          ?        ? 
1 1 1   29   16    3 o 50.36757 1.223960   71.27967   343.3   25.47111 1.232958          ?        ? 
1 1 1   29   16    4 o 27.29834 1.762577   38.82854    15.5   7.518036 0.9623086          ?        ? 
1 1 1   29   16    5 o 28.26640 1.702213   40.67746   218.2   8.059335 0.9623086          ?        ? 
1 1 1   29   16    6 o 32.73697 1.469758   45.35444   315.4   10.79590 0.9623086          ?        ? 
1 1 1   29   16    7 o 50.55788 1.130132   75.92026   101.2   25.68161 1.142741          ?        ? 
1 1 1   29   16    8 o 15.76547 2.479710   16.23610    24.4   2.556132 0.7818757          ?        ? 
1 1 1   29   16    9 o 7.983127 3.638985   15.78816    28.1 -0.6615872 1.293102          ?        ? 
1 1 1   29   16   10 o 13.30196 4.228717   19.17171    17.8   1.984761 1.263030          ?        ? 
1 1 1   29   16   11 o 12.29969 4.280087   23.03559   174.1   1.623896 1.293102          ?        ? 
1 1 1   29   16   12 o 10.47798 4.120778   4.380888   319.9  0.9623086 1.263030          ?        ? 
1 1 1   29   16   13 o 6.917278 3.286644   4.833507   197.7  -1.142741 1.232958          ?        ? 
1 1 1   29   16   14 o 23.34247 2.963094   26.74345   189.6   6.074574 1.383319          ?        ? 
1 1 1   29   17    0 o 14.63582 5.654439   45.53580     0.0   3.007215 1.563751   3.007215 1.563751 
1 1 1   29   17    1 o 47.66716 1.293299   64.38493   356.3   22.82476 1.232958          ?        ? 
1 1 1   29   17    2 o 53.87296 1.200140   83.60915   322.4   29.13991 1.293102          ?        ? 
1 1 1   29   17    3 o 16.37654 2.662626   31.92620   246.9   2.736565 0.8720922          ?        ? 
1 1 1   29   17    4 o 24.46139 1.844058   42.31158   282.1   6.044501 0.9021643          ?        ? 
1 1 1   29   17    5 o 11.36948 3.496441   3.345033   214.4   1.353247 0.8720922          ?        ? 
1 1 1   29   17    6 o 7.033864 3.095505   9.715652   247.8 -0.1804329 0.8420200          ?        ? 
1 1 1   29   17    7 o 10.67508 3.458724   15.55587    74.8   1.172814 0.8420200          ?        ? 
1 1 1   29   17    8 o 10.54986 3.520648   11.28336   274.8   1.142741 0.8720922          ?        ? 
1 1 1   29   17    9 o 11.61473 3.325011   22.20831    92.6   1.473535 0.8119479          ?        ? 
1 1 1   29   17   10 o 17.71744 3.923106   22.01387    74.9   3.548513 1.353247          ?        ? 
1 1 1   29   17   11 f 11.58753 4.210038   25.91092   359.3   1.383319 1.263030          ?        ? 
1 1 1   29   17   12 o 20.39346 3.317844   34.23186   288.6   4.570966 1.353247          ?        ? 
1 1 1   29   17   13 o 15.44484 4.042061   25.80314   184.8   2.947070 1.263030          ?        ? 
1 1 1   29   18    0 f 51.60555 1.928884   91.36906   180.0   26.88450 1.984761   26.88450 1.984761 
1 1 1   29   18    1 o 8.818475 3.583848   12.65045   200.7  0.3608657 0.9923807          ?        ? 
1 1 1   29   18    2 o 21.18893 2.483667   36.53035   231.8   4.570966 1.052525          ?        ? 
1 1 1   29   18    3 o 41.32991 1.309702   69.36605   183.6   17.17119 1.082597          ?        ? 
1 1 1   29   18    4 o 6.172959 2.940389   14.06839   153.2  -1.202886 0.9923807          ?        ? 
1 1 1   29   18    5 o 53.50397 1.208417   71.37923    82.4   28.77904 1.293102          ?        ? 
1 1 1   29   18    6 o 21.61901 2.086507   28.34678   329.2   4.751399 0.9021643          ?        ? 
1 1 1   29   18    7 o 20.54336 1.976182   27.74568   289.2   4.300317 0.8119479          ?        ? 
1 1 1   29   18    8 o 22.80391 1.846218   26.25923   296.0   5.292697 0.8420200          ?        ? 
1 1 1   29   18    9 o 21.86983 1.718815   27.09769   291.6   4.871688 0.7518036          ?        ? 
1 1 1   29   18   10 f 16.74765 4.073494   25.10722   325.9   3.217719 1.353247          ?        ? 
1 1 1   29   18   11 o 25.35910 2.608876   33.96372    18.1   6.796305 1.323174          ?        ? 
1 1 1   29   18   12 f 7.332151 3.441992   10.85040    95.3 -0.9923807 1.293102          ?        ? 
1 1 1   29   18   13 o 15.76844 4.072824   29.26948    45.1   3.097431 1.293102          ?        ? 
1 1 1   29   19    0 o 5.689025 3.942685   11.74003     0.0 -0.9021643 1.443463 -0.9021643 1.443463 
1 1 1   29   19    1 o 11.56349 3.922614   5.784813    31.5   1.323174 1.082597          ?        ? 
1 1 1   29   19    2 o 69.07001 1.044927   107.9025   171.4   47.87486 1.443463          ?        ? 
1 1 1   29   19    3 o 21.19272 2.270375   19.27994   117.3   4.570966 0.9623086          ?        ? 
1 1 1   29   19    4 o 10.68800 3.580835   19.56104   199.9   1.142741 0.9021643          ?        ? 
1 1 1   29   19    5 o 26.94619 1.674011   36.44989   187.1   7.337603 0.9021643          ?        ? 
1 1 1   29   19    6 o 7.202406 3.183202   5.448342     0.8 -0.2105050 0.9021643          ?        ? 
1 1 1   29   19    7 o 9.081008 3.458821   14.24632   240.6  0.6615872 0.8720922          ?        ? 
1 1 1   29   19    8 o 15.68307 2.588614   21.76686   140.3   2.556132 0.8119479          ?        ? 
1 1 1   29   19    9 o 10.20780 3.189229   19.16344   335.4   1.112669 0.7217315          ?        ? 
1 1 1   29   19   10 o 21.02366 3.361428   23.72517   332.1   4.781471 1.413391          ?        ? 
1 1 1   29   19   11 o 12.39804 4.328105   10.68891   100.8   1.744184 1.323174          ?        ? 
1 1 1   29   19   12 o 16.25493 4.074287   29.84467    28.8   3.247792 1.323174          ?        ? 
1 1 1   29   19   13 o 11.49843 4.289855   22.87329    37.5   1.563751 1.323174          ?        ? 
1 1 1   29   20    0 o 12.46977 5.583924   2.162432     0.0   2.345627 1.473535   2.345627 1.473535 
1 1 1   29   20    1 o 21.53953 2.233820   31.89697   163.6   4.721327 0.9623086          ?        ? 
1 1 1   29   20    2 o 31.73266 1.611042   45.80211   137.6   10.16438 1.022453          ?        ? 
1 1 1   29   20    3 o 14.75990 3.245923   17.07558   316.9   2.345627 0.9322364          ?        ? 
1 1 1   29   20    4 o 18.05622 2.498210   29.41989   118.1   3.338008 0.9021643          ?        ? 
1 1 1   29   20    5 o 30.64440 1.619188   49.23619   298.3   9.502798 0.9923807          ?        ? 
1 1 1   29   20    6 o 23.78015 2.023344   23.09343   306.7   5.773852 0.9623086          ?        ? 
1 1 1   29   20    7 o 8.060581 3.330735   14.32097   269.6  0.2706493 0.8720922          ?        ? 
1 1 1   29   20    8 o 16.29617 2.583491   31.03146   257.1   2.766637 0.8420200          ?        ? 
1 1 1   29   20    9 o 13.60323 2.854433   18.15571    50.6   2.014834 0.7518036          ?        ? 
1 1 1   29   20   10 o 13.65763 4.380730   4.972864    34.9   2.195267 1.353247          ?        ? 
1 1 1   29   20   11 o 11.98003 4.357296   9.589024   191.4   1.593824 1.353247          ?        ? 
1 1 1   29   20   12 o 9.819108 4.133546   15.12585   133.3  0.6615872 1.383319          ?        ? 
1 1 1   29   21    0 o 30.92783 2.764314   47.47819   180.0   9.923808 1.684040   9.923808 1.684040 
1 1 1   29   21    1 o 8.715376 3.501082   9.868737   144.9  0.4210100 0.9322364          ?        ? 
1 1 1   29   21    2 o 27.45851 1.861814   42.38360   279.8   7.638325 1.022453          ?        ? 
1 1 1   29   21    3 o 20.92930 2.370794   27.00156   326.5   4.480750 0.9923807          ?        ? 
1 1 1   29   21    4 o 13.04656 3.580903   17.58733   296.2   1.864473 0.9623086          ?        ? 
1 1 1   29   21    5 o 13.11494 3.572615   16.40689   162.7   1.894545 0.9623086          ?        ? 
1 1 1   29   21    6 o 36.46226 1.443308   51.04083   143.3   13.44225 1.052525          ?        ? 
1 1 1   29   21    7 o 16.54577 2.635394   26.64399   194.9   2.856854 0.8720922          ?        ? 
1 1 1   29   21    8 o 9.225368 3.373208   27.06439   323.4  0.7818757 0.8119479          ?        ? 
1 1 1   29   21    9 o 19.14746 2.120250   23.91217   281.9   3.789090 0.8119479          ?        ? 
1 1 1   29   21   10 o 5.989958 2.727263   9.051767   305.6 -0.3608657 0.7217315          ?        ? 
1 1 1   29   21   11 o 13.51192 4.482007   6.189142   357.1   2.285483 1.413391          ?        ? 
1 1 1   29   21   12 o 20.77931 3.328597   28.18530   184.0   4.931832 1.383319          ?        ? 
1 1 1   29   22    0 o 5.472709 3.716179   22.11201     0.0 -0.4510822 1.172814 -0.4510822 1.172814 
1 1 1   29   22    1 o 17.22151 2.793916   21.87639    50.9   3.067359 0.9623086          ?        ? 
1 1 1   29   22    2 o 22.09978 2.177190   37.30988   158.9   4.991976 0.9623086          ?        ? 
1 1 1   29   22    3 o 6.744668 3.099346   6.281031   112.6 -0.6315150 0.9623086          ?        ? 
1 1 1   29   22    4 o 28.32391 1.751843   42.08139   339.7   8.149551 0.9923807          ?        ? 
1 1 1   29   22    5 o 18.21749 2.806241   24.30348   104.6   3.458297 1.022453          ?        ? 
1 1 1   29   22    6 o 24.43266 1.907767   36.16704   172.4   6.104645 0.9322364          ?        ? 
1 1 1   29   22    7 o 18.23044 2.556813   30.80786   157.2   3.458297 0.9322364          ?        ? 
1 1 1   29   22    8 o 9.220187 3.558871   6.028879   312.6  0.6916593 0.9322364          ?        ? 
1 1 1   29   22    9 o 6.697508 3.009510   7.853078   156.6 -0.2706493 0.8420200          ?        ? 
1 1 1   29   22   10 o 11.06184 3.210226   21.31641     9.8   1.383319 0.7518036          ?        ? 
1 1 1   29   22   11 o 17.84644 4.123826   21.79246    73.1   3.939451 1.443463          ?        ? 
1 1 1   29   23    0 o 24.54143 2.820686   38.99956    -0.0   6.375295 1.353247   6.375295 1.353247 
1 1 1   29   23    1 o 7.707656 3.350726   21.37537   331.8      -0.06 0.9623086          ?        ? 
1 1 1   29   23    2 o 39.31920 1.491401   58.09208    28.1   15.63752 1.172814          ?        ? 
1 1 1   29   23    3 o 11.76484 3.811280   14.76064   338.3   1.473535 1.022453          ?        ? 
1 1 1   29   23    4 o 42.25242 1.387866   54.59822   114.3   18.04329 1.172814          ?        ? 
1 1 1   29   23    5 o 26.37023 1.995669   29.11290   137.3   7.127099 1.052525          ?        ? 
1 1 1   29   23    6 o 9.497724 3.670660   3.590056   298.7  0.7217315 0.9923807          ?        ? 
1 1 1   29   23    7 o 16.35006 3.056196   25.20765   257.6   2.916998 0.9623086          ?        ? 
1 1 1   29   23    8 o 19.32119 2.412472   25.65121   183.3   3.909379 0.9322364          ?        ? 
1 1 1   29   23    9 o 8.997086 3.359700   2.821372   150.8  0.7518036 0.8119479          ?        ? 
1 1 1   29   23   10 o 13.56967 2.859675   27.66121   125.3   2.074978 0.7518036          ?        ? 
1 1 1   29   23   11 o 11.73092 4.455217   22.27454    90.0   1.623896 1.443463          ?        ? 
1 1 1   29   24    0 f 37.08093 1.999161   47.50741   180.0   14.01362 1.473535   14.01362 1.473535 
1 1 1   29   24    1 o 20.11968 2.167261   25.49255   214.7   4.149956 0.8720922          ?        ? 
1 1 1   29   24    2 o 7.301898 3.250714   6.791742   215.9 -0.2706493 0.9623086          ?        ? 
1 1 1   29   24    3 o 13.32325 3.704897   13.75013   174.2   1.984761 1.022453          ?        ? 
1 1 1   29   24    4 o 23.72761 2.217933   35.30854   114.0   5.803924 1.052525          ?        ? 
1 1 1   29   24    5 o 20.19363 2.531622   32.79858   254.5   4.240172 1.022453          ?        ? 
1 1 1   29   24    6 o 11.06746 3.755618   4.672506   216.4   1.293102 0.9923807          ?        ? 
1 1 1   29   24    7 o 15.99045 3.120322   18.23085   191.2   2.826782 0.9623086          ?        ? 
1 1 1   29   24    8 o 19.41328 2.633385   24.07931   149.1   3.999595 1.022453          ?        ? 
1 1 1   29   24    9 o 6.636274 2.994215   19.28039   248.7 -0.2706493 0.8420200          ?        ? 
1 1 1   29   24   10 o 30.29417 1.538640   32.50686   309.8   9.442654 0.9322364          ?        ? 
1 1 1   29   25    0 o 30.65049 2.332401   30.03641   180.0   9.713303 1.413391   9.713303 1.413391 
1 1 1   29   25    1 o 16.47451 3.034343   18.16227     8.3   2.947070 0.9623086          ?        ? 
1 1 1   29   25    2 o 36.14964 1.414195   52.85692   306.1   13.23174 1.022453          ?        ? 
1 1 1   29   25    3 o 19.71394 2.440681   24.40004     4.9   4.029667 0.9623086          ?        ? 
1 1 1   29   25    4 f 12.52606 3.838920   18.36422   295.0   1.744184 1.052525          ?        ? 
1 1 1   29   25    5 o 19.25857 2.810690   14.91126   188.0   3.909379 1.082597          ?        ? 
1 1 1   29   25    6 o 14.83729 3.498402   14.33193    46.8   2.495988 1.022453          ?        ? 
1 1 1   29   25    7 o 28.72933 1.884133   38.28591    16.3   8.510417 1.082597          ?        ? 
1 1 1   29   25    8 o 12.06368 3.596178   6.609857   263.9   1.684040 0.9322364          ?        ? 
1 1 1   29   25    9 f 22.86316 2.104496   29.12119   221.4   5.503202 0.9623086          ?        ? 
1 1 1   29   26    0 o 18.54290 4.695396   7.351082   360.0   4.210100 1.503607   4.210100 1.503607 
1 1 1   29   26    1 f 30.93294 1.847127   42.91023   260.1   9.773447 1.142741          ?        ? 
1 1 1   29   26    2 o 7.388027 3.294739   3.566053    33.7 -0.2706493 0.9923807          ?        ? 
1 1 1   29   26    3 o 6.730961 3.095693   1.018680   271.9 -0.6014429 0.9623086          ?        ? 
1 1 1   29   26    4 o 10.21646 3.779040   26.19870    69.6  0.9923807 1.022453          ?        ? 
1 1 1   29   26    5 o 9.086591 3.627531   4.884383   230.6  0.6014429 0.9923807          ?        ? 
1 1 1   29   26    6 o 18.42712 2.855913   31.73229   290.4   3.638730 1.052525          ?        ? 
1 1 1   29   26    7 o 20.56412 2.486013   24.90605    70.7   4.480750 1.022453          ?        ? 
1 1 1   29   26    8 o 8.549401 3.574010   13.35061   349.1  0.4210100 1.022453          ?        ? 
1 1 1   29   26    9 o 19.58393 2.533661   17.84580   200.8   4.149956 0.9923807          ?        ? 
1 1 1   29   27    0 o 32.38652 2.155090   53.89724   180.0   10.79590 1.383319   10.79590 1.383319 
1 1 1   29   27    1 o 26.23148 1.948904   26.33089   178.1   7.066954 1.022453          ?        ? 
1 1 1   29   27    2 o 16.25301 2.978968   20.01826    96.0   2.886926 0.9322364          ?        ? 
1 1 1   29   27    3 o 9.746780 3.607837   2.870736   351.0  0.9021643 0.9322364          ?        ? 
1 1 1   29   27    4 o 8.512449 3.537378   19.15320   315.2  0.3608657 0.9923807          ?        ? 
1 1 1   29   27    5 o 13.79890 3.569747   23.09659   198.2   2.195267 0.9923807          ?        ? 
1 1 1   29   27    6 o 8.522046 3.625136   18.68549   343.6  0.2706493 1.082597          ?        ? 
1 1 1   29   27    7 o 9.983576 3.761782   7.563644   246.1   1.022453 1.022453          ?        ? 
1 1 1   29   27    8 o 24.42924 2.154232   23.97393   112.7   6.315150 1.052525          ?        ? 
1 1 1   29   28    0 o 19.96333 3.982508   31.04919     0.0   4.631110 1.413391   4.631110 1.413391 
1 1 1   29   28    1 o 11.77819 3.810852   22.92171   264.7   1.563751 1.022453          ?        ? 
1 1 1   29   28    2 o 13.08666 3.798567   15.39289   216.4   1.984761 1.052525          ?        ? 
1 1 1   29   28    3 f 12.02548 3.736214   20.56974   217.6   1.653968 0.9923807          ?        ? 
1 1 1   29   28    4 o 8.173308 3.527948   2.694793    45.8  0.1202886 1.052525          ?        ? 
1 1 1   29   28    5 o 6.946161 3.173243   6.251241   319.9 -0.4510822 0.9923807          ?        ? 
1 1 1   29   28    6 o 18.50922 2.599539   23.51975   317.5   3.698874 0.9623086          ?        ? 
1 1 1   29   28    7 o 6.956996 3.176136   4.516285   192.0 -0.3909379 0.9923807          ?        ? 
1 1 1   29   29    0 o 6.513625 4.298262   16.52862   180.0       0.03 1.383319       0.03 1.383319 
1 1 1   29   29    1 o 11.62797 3.812093   22.45963   114.3   1.533679 1.022453          ?        ? 
1 1 1   29   29    2 o 13.25193 3.636051   26.54398   200.7   2.044906 0.9923807          ?        ? 
1 1 1   29   29    3 o 17.20336 3.178607   20.74741   229.9   3.338008 1.052525          ?        ? 
1 1 1   29   29    4 o 6.377835 3.012616   5.461532   351.5 -0.9322364 1.022453          ?        ? 
1 1 1   29   29    5 o 29.39524 1.841450   37.03303   326.1   8.991571 1.082597          ?        ? 
1 1 1   29   29    6 o 5.557216 2.705527   13.59512     7.6  -1.443463 0.9623086          ?        ? 
1 1 1   29   30    0 o 5.361145 3.773085   9.619994   180.0  -1.112669 1.473535  -1.112669 1.473535 
1 1 1   29   30    1 o 7.649800 3.363589   5.180218   196.6   0.000000 0.9923807          ?        ? 
1 1 1   29   30    2 o 14.90052 3.488821   13.87598   303.3   2.616277 1.022453          ?        ? 
1 1 1   29   30    3 o 9.884439 3.750891   12.54545   320.8  0.9923807 1.022453          ?        ? 
1 1 1   29   30    4 o 10.74031 3.748359   14.44657   262.3   1.323174 0.9923807          ?        ? 
1 1 1   29   30    5 o 7.673347 3.390389   15.36460   107.0   0.000000 1.022453          ?        ? 
1 1 1   29   31    0 o 14.00859 5.437547   16.99062   180.0   3.007215 1.443463   3.007215 1.443463 
1 1 1   29   31    1 f 15.03710 3.716290   23.11061   313.4   2.736565 1.112669          ?        ? 
1 1 1   29   31    2 o 18.21555 2.889084   22.75711   103.7   3.668802 1.052525          ?        ? 
1 1 1   29   31    3 o 7.363765 3.312190   3.201139   245.7 -0.1804329 1.022453          ?        ? 
1 1 1   30    0    0 o 22.48179 4.979051   53.62650   180.0   5.773852 1.954689   5.773852 1.954689 
1 1 1   30    0    1 o 33.03239 2.204933   53.12739   180.0   11.09662 1.443463   11.09662 1.443463 
1 1 1   30    0    2 o 5.947609 4.007117   2.380584     0.0 -0.4510822 1.323174 -0.4510822 1.323174 
1 1 1   30    0    3 o 37.77734 2.001962   46.33083   180.0   14.43463 1.503607   14.43463 1.503607 
1 1 1   30    0    4 o 35.94368 1.978718   44.36204   180.0   13.08138 1.413391   13.08138 1.413391 
1 1 1   30    0    5 o 53.45771 1.521583   79.58763   180.0   28.71890 1.623896   28.71890 1.623896 
1 1 1   30    0    6 o 29.54638 2.423475   39.46757   180.0   8.961499 1.413391   8.961499 1.413391 
1 1 1   30    0    7 o 37.96596 2.032085   46.70369   180.0   14.61506 1.533679   14.61506 1.533679 
1 1 1   30    0    8 o 31.54978 2.018612   62.23278   180.0   10.13431 1.263030   10.13431 1.263030 
1 1 1   30    0    9 o 43.40635 1.458501   83.20779   180.0   18.97552 1.263030   18.97552 1.263030 
1 1 1   30    0   10 o 13.32947 4.347062   30.51048     0.0   2.315555 1.022453   2.315555 1.022453 
1 1 1   30    0   11 o 8.652512 5.828332   57.41405     0.0 -0.5112265 2.796710 -0.5112265 2.796710 
1 1 1   30    0   12 o 24.70435 7.897842   25.97789     0.0   8.630706 3.428224   8.630706 3.428224 
1 1 1   30    0   13 o 19.48253 8.094999   35.24812     0.0   6.224934 3.127503   6.224934 3.127503 
1 1 1   30    0   14 o 6.451177 4.671086   3.242763     0.0  -3.849235 2.886926  -3.849235 2.886926 
1 1 1   30    0   15 o 13.94417 7.105929   31.62338   180.0   3.789090 2.465916   3.789090 2.465916 
1 1 1   30    1    0 o 7.461319 4.532446   17.14425   180.0  0.5713707 1.232958  0.5713707 1.232958 
1 1 1   30    1    1 f 25.99701 1.908644   32.34715   290.8   6.796305 0.9923807          ?        ? 
1 1 1   30    1    2 f 34.27899 1.447506   67.90365   190.1   11.78828 0.9923807          ?        ? 
1 1 1   30    1    3 o 37.74123 1.354557   64.94479   197.2   14.28427 1.022453          ?        ? 
1 1 1   30    1    4 o 11.53827 3.628545   10.96722   279.2   1.353247 0.9322364          ?        ? 
1 1 1   30    1    5 o 30.44390 1.629852   47.48930   198.3   9.322365 0.9923807          ?        ? 
1 1 1   30    1    6 o 25.44240 1.891152   38.87726   212.4   6.525656 0.9623086          ?        ? 
1 1 1   30    1    7 o 22.55787 1.999667   36.63323    70.0   5.142337 0.9021643          ?        ? 
1 1 1   30    1    8 o 29.21745 1.595342   46.64325   232.2   8.600634 0.9322364          ?        ? 
1 1 1   30    1    9 o 20.73036 2.030886   47.88256   200.8   4.360461 0.8420200          ?        ? 
1 1 1   30    1   10 o 17.49105 2.321038   29.53600   193.6   3.127503 0.8119479          ?        ? 
1 1 1   30    1   11 o 17.92395 4.837017   23.56282   327.8   3.728946 1.774257          ?        ? 
1 1 1   30    1   12 o 36.53435 3.127855   55.06034    22.4   14.16398 2.285483          ?        ? 
1 1 1   30    1   13 o 13.73936 5.222387   5.765265   223.8   2.014834 1.984761          ?        ? 
1 1 1   30    1   14 o 8.797702 3.997612   16.24448   110.6 -0.4210100 1.533679          ?        ? 
1 1 1   30    1   15 o 10.24122 4.517139   24.84095    29.7  0.4210100 1.804329          ?        ? 
1 1 1   30    2    0 f 26.59517 2.589218   39.36748   180.0   7.307531 1.353247   7.307531 1.353247 
1 1 1   30    2    1 o 41.41998 1.306854   60.97406     3.4   17.20127 1.082597          ?        ? 
1 1 1   30    2    2 o 21.85426 2.201650   17.91073    74.2   4.811543 0.9623086          ?        ? 
1 1 1   30    2    3 o 23.56439 2.169487   34.62081    69.6   5.593419 1.022453          ?        ? 
1 1 1   30    2    4 o 28.08501 1.873820   54.11621   260.9   7.939046 1.052525          ?        ? 
1 1 1   30    2    5 f 20.89568 2.374608   37.29499   320.4   4.420605 0.9923807          ?        ? 
1 1 1   30    2    6 o 38.74713 1.241781   57.73217    23.4   15.06614 0.9623086          ?        ? 
1 1 1   30    2    7 o 6.176704 2.861979   10.11451   184.2 -0.6916593 0.8420200          ?        ? 
1 1 1   30    2    8 o 30.06472 1.650407   50.32848   325.9   9.111859 0.9923807          ?        ? 
1 1 1   30    2    9 f 31.11972 1.304555   43.14378   302.8   9.743376 0.8119479          ?        ? 
1 1 1   30    2   10 o 7.381956 3.199162   9.619906   105.5      -0.06 0.8720922          ?        ? 
1 1 1   30    2   11 o 12.58022 2.921911   9.863523   206.7   1.714112 0.7217315          ?        ? 
1 1 1   30    2   12 o 13.35916 5.037396   24.14171    75.5   1.804329 1.834401          ?        ? 
1 1 1   30    2   13 o 24.41431 3.879989   34.14661   123.9   6.615872 1.894545          ?        ? 
1 1 1   30    2   14 o 9.881628 4.496245   21.92945   338.8 -0.3909379 1.954689          ?        ? 
1 1 1   30    2   15 o 12.21607 4.858725   12.00094   243.8   1.714112 1.774257          ?        ? 
1 1 1   30    3    0 o 44.97901 1.676531   70.58617     0.0   20.35884 1.503607   20.35884 1.503607 
1 1 1   30    3    1 o 57.09878 1.053338   70.02677   344.8   32.65835 1.202886          ?        ? 
1 1 1   30    3    2 o 22.19582 2.167770   43.71385    66.3   4.961904 0.9623086          ?        ? 
1 1 1   30    3    3 o 40.24608 1.270252   55.39491   205.7   16.23896 1.022453          ?        ? 
1 1 1   30    3    4 o 22.03218 2.252117   26.14192   169.1   4.901759 0.9923807          ?        ? 
1 1 1   30    3    5 o 42.58603 1.200456   73.23759   338.0   18.19365 1.022453          ?        ? 
1 1 1   30    3    6 o 20.23204 2.452498   47.29525    27.4   4.149956 0.9923807          ?        ? 
1 1 1   30    3    7 o 15.79435 3.157999   27.91973   173.7   2.646349 0.9623086          ?        ? 
1 1 1   30    3    8 o 12.98696 3.153151   25.23879    80.8   1.804329 0.8119479          ?        ? 
1 1 1   30    3    9 o 4.803957 2.339564   9.012401   244.0  -1.263030 0.7217315          ?        ? 
1 1 1   30    3   10 o 32.17453 1.588917   56.25451   349.8   10.46511 1.022453          ?        ? 
1 1 1   30    3   11 o 7.922187 3.234291   7.774028     0.3  0.3007214 0.8119479          ?        ? 
1 1 1   30    3   12 o 14.26686 3.668730   24.00584    26.9   2.285483 1.052525          ?        ? 
1 1 1   30    3   13 o 8.937416 4.119028   12.05907    44.0 -0.8420200 1.714112          ?        ? 
1 1 1   30    3   14 o 11.15756 4.430967   16.26796    58.0   1.142741 1.473535          ?        ? 
1 1 1   30    3   15 o 11.52684 4.822981   15.88269   167.1   1.263030 1.864473          ?        ? 
1 1 1   30    4    0 o 4.071553 2.950073   9.178272   180.0  -1.984761 1.172814  -1.984761 1.172814 
1 1 1   30    4    1 o 40.65385 1.294496   50.66710    40.5   16.56975 1.052525          ?        ? 
1 1 1   30    4    2 f 77.57452 0.9691374   108.4608    97.0   60.26458 1.503607          ?        ? 
1 1 1   30    4    3 o 45.03656 1.168523   64.83794   111.6   20.32877 1.052525          ?        ? 
1 1 1   30    4    4 o 40.79206 1.216390   65.09859    79.5   16.69004 0.9923807          ?        ? 
1 1 1   30    4    5 o 36.60559 1.560884   62.14960    61.5   13.47232 1.142741          ?        ? 
1 1 1   30    4    6 o 21.08585 2.495809   36.15495    58.3   4.510822 1.052525          ?        ? 
1 1 1   30    4    7 o 17.34099 2.687957   25.27636   286.6   3.067359 0.9322364          ?        ? 
1 1 1   30    4    8 o 4.982431 2.437210   13.43718    47.6  -1.533679 0.8119479          ?        ? 
1 1 1   30    4    9 o 31.71223 1.137939   45.80516   237.7   10.10424 0.7217315          ?        ? 
1 1 1   30    4   10 o 15.14283 3.365073   24.78443    34.9   2.495988 0.9923807          ?        ? 
1 1 1   30    4   11 o 12.82084 3.360326   16.67934   306.3   1.804329 0.8720922          ?        ? 
1 1 1   30    4   12 o 30.88901 1.849754   42.25287     6.3   9.743376 1.142741          ?        ? 
1 1 1   30    4   13 o 20.50086 2.420339   25.15568   321.3   4.390533 0.9923807          ?        ? 
1 1 1   30    4   14 o 14.67828 5.021690   23.10788   271.2   2.706493 1.774257          ?        ? 
1 1 1   30    4   15 o 10.11828 4.468994   6.243742   315.1  0.3909379 1.774257          ?        ? 
1 1 1   30    5    0 o 29.63005 2.416315   62.24673   180.0   8.991571 1.413391   8.991571 1.413391 
1 1 1   30    5    1 o 23.64826 1.907465   38.38398   198.6   5.623491 0.9021643          ?        ? 
1 1 1   30    5    2 o 47.21200 1.242072   61.82117   171.0   22.34361 1.172814          ?        ? 
1 1 1   30    5    3 o 7.355745 3.310188   6.675718   240.7 -0.4811543 1.022453          ?        ? 
1 1 1   30    5    4 o 28.11864 1.925052   51.32058   255.9   7.969118 1.082597          ?        ? 
1 1 1   30    5    5 o 10.57470 3.793235   31.85475   347.9  0.9923807 1.022453          ?        ? 
1 1 1   30    5    6 o 12.56461 3.770371   7.748272   272.6   1.653968 1.022453          ?        ? 
1 1 1   30    5    7 o 42.25336 1.174322   60.66589   200.5   17.92300 0.9923807          ?        ? 
1 1 1   30    5    8 o 10.43715 3.580472   34.58935   162.9   1.052525 0.9021643          ?        ? 
1 1 1   30    5    9 o 13.22840 3.558857   21.19375   283.3   1.894545 0.9623086          ?        ? 
1 1 1   30    5   10 o 27.02699 1.891541   35.12781   328.7   7.427820 1.022453          ?        ? 
1 1 1   30    5   11 o 10.63265 3.520649   6.199437   259.4   1.172814 0.8720922          ?        ? 
1 1 1   30    5   12 o 11.00297 3.858337   10.56194    70.0   1.232958 1.052525          ?        ? 
1 1 1   30    5   13 o 25.01933 2.043326   43.87664   145.3   6.465511 1.022453          ?        ? 
1 1 1   30    5   14 o 5.951583 2.839212   5.618363   322.5  -1.022453 0.9322364          ?        ? 
1 1 1   30    5   15 o 8.704172 3.905457   12.75002    45.8      -0.06 1.413391          ?        ? 
1 1 1   30    6    0 o 12.58131 5.696698   19.35160   180.0   2.345627 1.533679   2.345627 1.533679 
1 1 1   30    6    1 o 21.43568 2.244642   48.88175   141.9   4.631110 0.9623086          ?        ? 
1 1 1   30    6    2 o 13.79145 3.397486   39.54993   160.7   2.014834 0.9322364          ?        ? 
1 1 1   30    6    3 o 23.15646 2.207705   19.67598   243.1   5.412986 1.022453          ?        ? 
1 1 1   30    6    4 o 24.03437 2.127064   31.08628   286.7   5.833996 1.022453          ?        ? 
1 1 1   30    6    5 o 58.26079 1.135562   81.78666   284.3   34.04167 1.323174          ?        ? 
1 1 1   30    6    6 o 35.44164 1.484871   57.73565    36.2   12.63030 1.052525          ?        ? 
1 1 1   30    6    7 o 22.92689 2.098646   40.99880    35.8   5.322770 0.9623086          ?        ? 
1 1 1   30    6    8 o 20.73386 2.103062   45.55644   164.8   4.360461 0.8720922          ?        ? 
1 1 1   30    6    9 o 10.18550 3.625167   27.31635   256.9  0.9623086 0.9322364          ?        ? 
1 1 1   30    6   10 o 11.94936 3.740973   12.99261   101.8   1.533679 0.9923807          ?        ? 
1 1 1   30    6   11 o 18.83411 2.474861   21.30123    83.3   3.668802 0.9322364          ?        ? 
1 1 1   30    6   12 f 10.18919 3.517881   22.39651     4.6   1.052525 0.8720922          ?        ? 
1 1 1   30    6   13 o 5.635149 2.773205   8.155329   156.0  -2.014834 1.082597          ?        ? 
1 1 1   30    6   14 o 21.70275 2.424865   25.63175   349.2   4.991976 1.052525          ?        ? 
1 1 1   30    6   15 o 14.77288 3.423022   27.66849    51.9   2.586205 0.9923807          ?        ? 
1 1 1   30    7    0 o 21.60182 3.400591   48.98124   360.0   4.961904 1.383319   4.961904 1.383319 
1 1 1   30    7    1 o 53.77323 1.230328   76.90005    18.2   28.98955 1.323174          ?        ? 
1 1 1   30    7    2 o 27.86489 1.942583   61.16176   284.3   7.818758 1.082597          ?        ? 
1 1 1   30    7    3 o 12.58904 3.768890   5.997971    86.8   1.653968 1.022453          ?        ? 
1 1 1   30    7    4 o 28.54488 1.843632   36.60808   165.3   8.209695 1.052525          ?        ? 
1 1 1   30    7    5 o 28.32356 1.911125   54.04158   232.3   8.089407 1.082597          ?        ? 
1 1 1   30    7    6 o 27.27805 1.984375   33.41615    21.5   7.518036 1.082597          ?        ? 
1 1 1   30    7    7 o 43.17976 1.288415   52.75090    78.9   18.73495 1.112669          ?        ? 
1 1 1   30    7    8 o 10.51196 3.459418   26.64484   198.5   1.112669 0.8420200          ?        ? 
1 1 1   30    7    9 o 20.05433 2.549207   32.91339   121.7   4.119884 1.022453          ?        ? 
1 1 1   30    7   10 o 14.85223 3.580032   28.11729   264.5   2.435844 1.052525          ?        ? 
1 1 1   30    7   11 o 12.14913 3.590580   28.57501   227.4   1.623896 0.9322364          ?        ? 
1 1 1   30    7   12 o 25.70709 1.930169   39.18967   239.7   6.766232 0.9923807          ?        ? 
1 1 1   30    7   13 o 20.76125 2.824526   32.04111   120.1   4.601038 1.172814          ?        ? 
1 1 1   30    7   14 o 17.98977 3.553299   30.13001   253.5   3.759018 1.232958          ?        ? 
1 1 1   30    7   15 o 7.659408 3.405071   13.11401    51.1      -0.06 1.052525          ?        ? 
1 1 1   30    8    0 o 43.46629 1.910534   63.70343    -0.0   19.06574 1.653968   19.06574 1.653968 
1 1 1   30    8    1 o 25.69387 1.872642   33.74929    75.9   6.645944 0.9623086          ?        ? 
1 1 1   30    8    2 o 8.264195 3.519451   15.25219   115.5       0.03 1.022453          ?        ? 
1 1 1   30    8    3 o 28.95173 1.921594   45.83139   218.8   8.450273 1.112669          ?        ? 
1 1 1   30    8    4 o 16.94885 3.311843   34.54164   159.6   3.037287 1.082597          ?        ? 
1 1 1   30    8    5 o 20.15265 2.462159   37.88583   296.1   4.119884 0.9923807          ?        ? 
1 1 1   30    8    6 o 8.825177 3.584762   18.54832    26.0  0.3608657 0.9923807          ?        ? 
1 1 1   30    8    7 o 7.146452 3.213933   9.351519   164.9 -0.4210100 0.9623086          ?        ? 
1 1 1   30    8    8 o 11.25442 2.916183   24.33327   304.1   1.353247 0.6615872          ?        ? 
1 1 1   30    8    9 o 21.53030 2.514125   41.62934   299.9   4.751399 1.082597          ?        ? 
1 1 1   30    8   10 o 9.063342 3.655906   5.462708   196.9  0.4811543 1.022453          ?        ? 
1 1 1   30    8   11 o 15.83515 3.333313   25.32264   354.2   2.766637 1.022453          ?        ? 
1 1 1   30    8   12 o 8.797174 3.547490   17.09635    44.7  0.4811543 0.9623086          ?        ? 
1 1 1   30    8   13 o 12.61852 4.186157   28.12136   140.3   1.834401 1.232958          ?        ? 
1 1 1   30    8   14 o 8.735556 3.795097   12.44112   201.5  0.2105050 1.232958          ?        ? 
1 1 1   30    9    0 o 40.24576 2.028419   63.90061     0.0   16.38932 1.623896   16.38932 1.623896 
1 1 1   30    9    1 o 51.85536 1.217839   75.96917   258.5   26.97471 1.263030          ?        ? 
1 1 1   30    9    2 o 57.32225 1.180385   94.82706   152.5   32.95907 1.353247          ?        ? 
1 1 1   30    9    3 o 38.06044 1.461714   50.70589   251.9   14.55492 1.112669          ?        ? 
1 1 1   30    9    4 f 8.519338 3.538631   29.62924   225.0  0.2105050 0.9923807          ?        ? 
1 1 1   30    9    5 o 25.46672 2.066471   42.59510     8.7   6.555727 1.052525          ?        ? 
1 1 1   30    9    6 o 11.54368 3.755612   24.56956    69.8   1.353247 0.9923807          ?        ? 
1 1 1   30    9    7 o 9.020535 3.616992   8.482571    42.0  0.4510822 0.9923807          ?        ? 
1 1 1   30    9    8 o 5.633898 2.580908   19.23727    62.2 -0.4510822 0.6615872          ?        ? 
1 1 1   30    9    9 o 14.03879 3.773774   21.65114    80.1   2.165194 1.082597          ?        ? 
1 1 1   30    9   10 o 12.45279 3.909063   9.898432    10.0   1.684040 1.082597          ?        ? 
1 1 1   30    9   11 o 6.905649 3.182108   3.159587   134.9 -0.6615872 1.022453          ?        ? 
1 1 1   30    9   12 o 8.179346 3.529219   18.29882   109.7       0.06 1.052525          ?        ? 
1 1 1   30    9   13 o 23.87499 2.834025   36.13495   263.3   6.104645 1.353247          ?        ? 
1 1 1   30    9   14 o 8.596055 3.786982   12.91684   360.0       0.09 1.263030          ?        ? 
1 1 1   30   10    0 o 42.09654 1.865218   74.35131   180.0   17.89293 1.563751   17.89293 1.563751 
1 1 1   30   10    1 o 35.56418 1.606591   56.56201   158.6   12.72052 1.142741          ?        ? 
1 1 1   30   10    2 o 22.49599 2.138845   35.02195   284.4   5.112265 0.9623086          ?        ? 
1 1 1   30   10    3 o 10.08094 3.724222   6.152709   186.6  0.8420200 0.9923807          ?        ? 
1 1 1   30   10    4 o 14.62781 3.445003   23.27169   250.4   2.285483 0.9923807          ?        ? 
1 1 1   30   10    5 o 23.04720 2.218172   41.13468   247.7   5.382914 1.022453          ?        ? 
1 1 1   30   10    6 o 35.12694 1.498174   42.52820   304.8   12.41980 1.052525          ?        ? 
1 1 1   30   10    7 o 20.66776 2.037037   47.41679   222.1   4.330389 0.8420200          ?        ? 
1 1 1   30   10    8 o 12.90259 2.760560   13.43977   170.4   1.774257 0.6916593          ?        ? 
1 1 1   30   10    9 o 13.42500 3.838166   15.92157    64.3   1.984761 1.082597          ?        ? 
1 1 1   30   10   10 o 21.97679 2.736719   30.03590   186.5   5.022048 1.202886          ?        ? 
1 1 1   30   10   11 o 13.77072 3.806267   14.72093   145.7   2.135122 1.082597          ?        ? 
1 1 1   30   10   12 o 18.79257 2.960397   28.21790   201.6   3.759018 1.112669          ?        ? 
1 1 1   30   10   13 o 15.55073 3.472808   18.36209   219.5   2.766637 1.052525          ?        ? 
1 1 1   30   10   14 o 8.509438 3.799373  0.6696230   107.7      -0.06 1.323174          ?        ? 
1 1 1   30   11    0 o 49.87289 1.753369   82.40578   180.0   25.05010 1.744184   25.05010 1.744184 
1 1 1   30   11    1 o 37.88620 1.587498   60.47842    97.7   14.43463 1.202886          ?        ? 
1 1 1   30   11    2 o 39.26929 1.378428   59.34117    19.1   15.48715 1.082597          ?        ? 
1 1 1   30   11    3 o 38.53148 1.404822   57.66109    12.9   14.91578 1.082597          ?        ? 
1 1 1   30   11    4 o 14.89302 3.489958   30.31637   244.6   2.375700 1.022453          ?        ? 
1 1 1   30   11    5 o 40.56053 1.371616   69.82043   238.5   16.53968 1.112669          ?        ? 
1 1 1   30   11    6 o 18.55670 2.673916   32.86236   285.2   3.518441 0.9923807          ?        ? 
1 1 1   30   11    7 o 19.23681 2.110402   32.56157   281.8   3.759018 0.8119479          ?        ? 
1 1 1   30   11    8 o 34.59130 1.173630   52.65549   308.3   12.02886 0.8119479          ?        ? 
1 1 1   30   11    9 o 7.039213 3.299699   1.787686    56.0  -1.052525 1.172814          ?        ? 
1 1 1   30   11   10 o 11.46590 3.972150   24.43634    36.6   1.353247 1.112669          ?        ? 
1 1 1   30   11   11 o 16.20595 3.698602   19.40798   169.7   2.947070 1.172814          ?        ? 
1 1 1   30   11   12 o 10.58668 4.017277   8.607545   171.1   1.052525 1.172814          ?        ? 
1 1 1   30   11   13 o 12.60864 3.963978   20.04161   175.5   1.864473 1.112669          ?        ? 
1 1 1   30   11   14 o 14.59801 4.500122   23.79337   167.5   2.766637 1.443463          ?        ? 
1 1 1   30   12    0 o 25.54799 2.702101   26.75950     0.0   6.796305 1.353247   6.796305 1.353247 
1 1 1   30   12    1 o 27.63039 1.904651   45.76268   256.3   7.698469 1.052525          ?        ? 
1 1 1   30   12    2 o 44.51134 1.418773   67.87163    69.8   19.90776 1.263030          ?        ? 
1 1 1   30   12    3 o 33.61594 1.520786   54.05730    92.6   11.36727 1.022453          ?        ? 
1 1 1   30   12    4 o 30.05731 1.750864   45.43926    28.1   9.111859 1.052525          ?        ? 
1 1 1   30   12    5 o 8.279385 3.522488   23.58813   323.0       0.06 1.022453          ?        ? 
1 1 1   30   12    6 o 37.89339 1.269758   48.05408   149.0   14.43463 0.9623086          ?        ? 
1 1 1   30   12    7 o 9.077624 3.415076   5.897967   217.9  0.6615872 0.8420200          ?        ? 
1 1 1   30   12    8 o 16.15719 2.419591   25.93601    61.8   2.676421 0.7818757          ?        ? 
1 1 1   30   12    9 o 21.92008 2.743798   32.34728    71.0   4.991976 1.202886          ?        ? 
1 1 1   30   12   10 o 15.75361 3.767614   27.55772    40.7   2.796710 1.172814          ?        ? 
1 1 1   30   12   11 o 18.14808 3.438899   19.73565   265.9   3.638730 1.202886          ?        ? 
1 1 1   30   12   12 o 7.595601 3.463213   12.33780   162.8 -0.5112265 1.172814          ?        ? 
1 1 1   30   12   13 o 21.11317 2.635013   27.76764   354.9   4.781471 1.112669          ?        ? 
1 1 1   30   12   14 o 7.112721 3.426368   11.05565   291.9  -1.563751 1.443463          ?        ? 
1 1 1   30   13    0 o 6.349202 4.176956   23.11563   180.0      -0.09 1.293102      -0.09 1.293102 
1 1 1   30   13    1 o 13.82160 3.566994   30.20270   341.3   2.044906 0.9923807          ?        ? 
1 1 1   30   13    2 o 27.53412 1.692875   40.83762   193.2   7.638325 0.9322364          ?        ? 
1 1 1   30   13    3 o 25.17286 1.971133   37.42044   125.1   6.405366 0.9923807          ?        ? 
1 1 1   30   13    4 o 39.31011 1.453496   70.32679   182.7   15.54730 1.142741          ?        ? 
1 1 1   30   13    5 o 33.71455 1.605534   43.38154    76.3   11.45749 1.082597          ?        ? 
1 1 1   30   13    6 o 15.02649 3.008068   31.42830   341.7   2.405771 0.8720922          ?        ? 
1 1 1   30   13    7 o 22.78449 1.913785   38.13036    32.3   5.262625 0.8720922          ?        ? 
1 1 1   30   13    8 o 17.98182 2.174073   22.98981   331.5   3.307936 0.7818757          ?        ? 
1 1 1   30   13    9 o 11.82963 4.173211   14.64511    48.6   1.413391 1.232958          ?        ? 
1 1 1   30   13   10 o 33.13567 1.860469   45.59568   178.2   11.21691 1.232958          ?        ? 
1 1 1   30   13   11 o 11.92582 4.082781   9.558522   348.2   1.533679 1.172814          ?        ? 
1 1 1   30   13   12 o 29.52945 1.985837   35.52934   351.0   9.021644 1.172814          ?        ? 
1 1 1   30   13   13 o 8.237362 3.592097   16.21695   341.3  0.1202886 1.112669          ?        ? 
1 1 1   30   14    0 o 6.678030 4.308661   8.171799   180.0  0.1202886 1.293102  0.1202886 1.293102 
1 1 1   30   14    1 o 16.51804 3.117832   18.74392    61.0   2.886926 0.9923807          ?        ? 
1 1 1   30   14    2 o 7.288433 3.226643   32.96814   245.5 -0.2706493 0.9322364          ?        ? 
1 1 1   30   14    3 o 9.203403 3.679255   23.54687    87.5  0.4811543 1.022453          ?        ? 
1 1 1   30   14    4 o 16.22039 3.172184   35.30880   160.4   2.796710 0.9923807          ?        ? 
1 1 1   30   14    5 o 13.58487 3.248835   25.98630   226.9   1.984761 0.8720922          ?        ? 
1 1 1   30   14    6 o 11.64262 3.403398   35.30812   225.1   1.443463 0.8420200          ?        ? 
1 1 1   30   14    7 o 12.14851 3.435845   9.260071    34.1   1.593824 0.8720922          ?        ? 
1 1 1   30   14    8 o 7.778415 3.213967   7.338928   140.9  0.2405772 0.8119479          ?        ? 
1 1 1   30   14    9 o 7.098899 3.339721   9.976331   158.7  -1.172814 1.232958          ?        ? 
1 1 1   30   14   10 o 16.31793 3.837945   28.09597   199.0   3.007215 1.232958          ?        ? 
1 1 1   30   14   11 o 14.08793 4.242678   20.44719   238.6   2.315555 1.293102          ?        ? 
1 1 1   30   14   12 o 8.658791 3.730633   19.88817   130.2  0.1804329 1.172814          ?        ? 
1 1 1   30   14   13 o 25.50990 2.534511   40.16452   146.3   7.006810 1.293102          ?        ? 
1 1 1   30   15    0 o 8.504508 5.000459   26.21188    -0.0  0.9322364 1.413391  0.9322364 1.413391 
1 1 1   30   15    1 o 54.19262 1.248553   76.68913     1.5   29.50077 1.353247          ?        ? 
1 1 1   30   15    2 o 40.02211 1.465207   68.45425   317.4   16.11867 1.172814          ?        ? 
1 1 1   30   15    3 o 16.51866 3.025519   33.03613   107.4   2.886926 0.9623086          ?        ? 
1 1 1   30   15    4 o 17.60889 2.903230   32.46030   139.0   3.187647 1.022453          ?        ? 
1 1 1   30   15    5 o 13.98902 3.187122   25.29192    63.0   2.105050 0.8720922          ?        ? 
1 1 1   30   15    6 o 21.63049 2.015886   27.79506   186.1   4.751399 0.8720922          ?        ? 
1 1 1   30   15    7 o 27.46970 1.587371   38.89766   293.8   7.638325 0.8720922          ?        ? 
1 1 1   30   15    8 o 14.78401 2.847651   15.79827   123.4   2.345627 0.8119479          ?        ? 
1 1 1   30   15    9 o 10.65237 4.024577   14.96365   134.5   1.022453 1.172814          ?        ? 
1 1 1   30   15   10 o 13.44077 4.222881   13.94867   113.3   2.044906 1.263030          ?        ? 
1 1 1   30   15   11 o 10.12438 4.130318   4.411958    45.7  0.7217315 1.323174          ?        ? 
1 1 1   30   15   12 f 15.36847 3.980484   28.48834   193.8   2.826782 1.232958          ?        ? 
1 1 1   30   15   13 o 14.85753 4.113243   30.10895   184.4   2.766637 1.263030          ?        ? 
1 1 1   30   16    0 f 9.451617 5.058828   4.243986   180.0   1.353247 1.293102   1.353247 1.293102 
1 1 1   30   16    1 o 34.76241 1.600392   54.30590   237.0   12.17922 1.112669          ?        ? 
1 1 1   30   16    2 o 15.04011 3.467653   37.17403   106.6   2.435844 1.022453          ?        ? 
1 1 1   30   16    3 o 16.35464 3.241126   31.00214   140.5   2.856854 1.022453          ?        ? 
1 1 1   30   16    4 o 25.15252 1.853167   32.07158   283.7   6.405366 0.9322364          ?        ? 
1 1 1   30   16    5 f 21.51702 1.886757   38.79341    22.8   4.691255 0.8119479          ?        ? 
1 1 1   30   16    6 o 8.785620 3.431587   11.49084   121.9  0.5412986 0.8720922          ?        ? 
1 1 1   30   16    7 o 17.14445 2.543365   40.51728   276.3   3.037287 0.8720922          ?        ? 
1 1 1   30   16    8 o 19.49520 2.236684   31.24574     7.3   3.909379 0.8720922          ?        ? 
1 1 1   30   16    9 o 11.54778 4.117121   11.45582   177.1   1.353247 1.202886          ?        ? 
1 1 1   30   16   10 o 18.44813 3.634129   17.84876   358.2   3.819162 1.293102          ?        ? 
1 1 1   30   16   11 o 11.05923 4.211914   22.63324   112.0   1.202886 1.293102          ?        ? 
1 1 1   30   16   12 o 12.76405 4.186162   18.68010   134.9   1.984761 1.232958          ?        ? 
1 1 1   30   16   13 o 9.445777 3.935168   20.39090   307.6  0.6615872 1.232958          ?        ? 
1 1 1   30   17    0 o 10.88040 5.411128   10.21237   180.0   1.834401 1.413391   1.834401 1.413391 
1 1 1   30   17    1 o 5.750994 2.813415   13.76452   301.7  -2.014834 1.082597          ?        ? 
1 1 1   30   17    2 o 24.20013 2.174627   37.36154   120.5   5.954284 1.052525          ?        ? 
1 1 1   30   17    3 o 26.99659 1.726582   35.10938   215.4   7.367675 0.9322364          ?        ? 
1 1 1   30   17    4 o 30.03366 1.652114   49.94992   276.3   9.111859 0.9923807          ?        ? 
1 1 1   30   17    5 o 6.587256 2.957749   11.31320    11.3 -0.3307936 0.8119479          ?        ? 
1 1 1   30   17    6 o 28.72306 1.622801   44.98367   166.7   8.360056 0.9322364          ?        ? 
1 1 1   30   17    7 o 15.21784 2.971351   29.70498   209.6   2.495988 0.8720922          ?        ? 
1 1 1   30   17    8 o 16.45383 2.650120   35.52674   100.3   2.826782 0.8720922          ?        ? 
1 1 1   30   17    9 o 10.99247 4.240549   16.77668   355.1   1.052525 1.323174          ?        ? 
1 1 1   30   17   10 o 15.51306 4.103779   26.98285   328.3   2.826782 1.293102          ?        ? 
1 1 1   30   17   11 o 12.89692 4.236905   22.00491    32.7   1.954689 1.263030          ?        ? 
1 1 1   30   17   12 o 8.538572 3.771019   5.026927    66.1       0.06 1.263030          ?        ? 
1 1 1   30   18    0 o 12.25072 5.740948   35.66945   180.0   2.315555 1.563751   2.315555 1.563751 
1 1 1   30   18    1 o 19.51327 2.696947   19.81522    55.5   3.909379 1.052525          ?        ? 
1 1 1   30   18    2 o 9.819666 3.783327   19.18947   175.4  0.7217315 1.052525          ?        ? 
1 1 1   30   18    3 o 16.40305 2.948957   19.59651   277.9   2.856854 0.9322364          ?        ? 
1 1 1   30   18    4 o 9.222614 3.425825   12.55311   235.7  0.7217315 0.8420200          ?        ? 
1 1 1   30   18    5 o 27.37288 1.757778   29.80987   327.5   7.608253 0.9623086          ?        ? 
1 1 1   30   18    6 o 34.80154 1.425771   48.19410    42.6   12.23936 0.9923807          ?        ? 
1 1 1   30   18    7 o 12.78642 3.277512   20.50643   325.4   1.804329 0.8420200          ?        ? 
1 1 1   30   18    8 o 5.949268 2.790053   1.996366   154.9 -0.7818757 0.8420200          ?        ? 
1 1 1   30   18    9 o 20.93175 1.795845   19.31925   312.8   4.480750 0.7518036          ?        ? 
1 1 1   30   18   10 o 14.26494 4.349118   20.29613   111.7   2.435844 1.353247          ?        ? 
1 1 1   30   18   11 o 14.15163 4.297732   23.85341   351.2   2.465916 1.323174          ?        ? 
1 1 1   30   18   12 o 12.53898 4.287047   14.11098   101.3   1.954689 1.293102          ?        ? 
1 1 1   30   19    0 o 4.414371 3.196325  0.9391376   360.0  -2.165194 1.353247  -2.165194 1.353247 
1 1 1   30   19    1 o 13.21760 3.786287   17.63414   287.1   1.894545 1.052525          ?        ? 
1 1 1   30   19    2 o 42.98961 1.329090   66.87308   286.8   18.61466 1.142741          ?        ? 
1 1 1   30   19    3 o 15.23009 3.069487   37.58629   341.9   2.495988 0.9021643          ?        ? 
1 1 1   30   19    4 o 8.698477 3.463068   22.74726   212.6  0.4811543 0.9021643          ?        ? 
1 1 1   30   19    5 o 25.19032 1.910077   42.93906   319.5   6.465511 0.9623086          ?        ? 
1 1 1   30   19    6 o 34.27301 1.403887   46.98345    66.2   11.87850 0.9623086          ?        ? 
1 1 1   30   19    7 o 21.85120 2.064336   23.57572    70.3   4.901759 0.9021643          ?        ? 
1 1 1   30   19    8 o 11.46302 3.417869   17.22382    31.4   1.443463 0.8420200          ?        ? 
1 1 1   30   19    9 o 10.17495 3.333579   13.46016   114.3   1.112669 0.7818757          ?        ? 
1 1 1   30   19   10 o 13.89366 4.313719   13.22747    29.1   2.315555 1.323174          ?        ? 
1 1 1   30   19   11 o 10.12646 4.161680   20.86498   236.1  0.8420200 1.353247          ?        ? 
1 1 1   30   20    0 o 15.54264 6.027406   37.64605     0.0   3.488369 1.774257   3.488369 1.774257 
1 1 1   30   20    1 o 21.34925 2.183300   29.36189   200.0   4.661182 0.9322364          ?        ? 
1 1 1   30   20    2 o 8.740037 3.608670   17.23023    58.9  0.3307936 1.022453          ?        ? 
1 1 1   30   20    3 o 7.114728 3.206010   7.061452   335.3 -0.3909379 0.9623086          ?        ? 
1 1 1   30   20    4 o 9.916477 3.615568   14.12719    59.3  0.9021643 0.9322364          ?        ? 
1 1 1   30   20    5 o 27.61866 1.742135   34.72033    39.6   7.758613 0.9623086          ?        ? 
1 1 1   30   20    6 o 8.875218 3.524437   18.37080   124.6  0.5412986 0.9322364          ?        ? 
1 1 1   30   20    7 o 9.992553 3.511318   16.09823   149.1  0.9923807 0.8720922          ?        ? 
1 1 1   30   20    8 o 9.267284 3.374705   8.942204   235.2  0.8119479 0.8119479          ?        ? 
1 1 1   30   20    9 o 13.12306 3.036804   12.99224    68.3   1.924617 0.7818757          ?        ? 
1 1 1   30   20   10 f 11.75099 4.347402   15.84499   219.0   1.533679 1.353247          ?        ? 
1 1 1   30   20   11 o 11.28531 4.234768   15.34424   143.7   1.443463 1.293102          ?        ? 
1 1 1   30   21    0 o 6.013431 4.180647   16.08053     0.0  -1.112669 1.684040  -1.112669 1.684040 
1 1 1   30   21    1 o 13.21384 3.560623   12.32396    52.0   1.924617 0.9623086          ?        ? 
1 1 1   30   21    2 o 24.37020 2.097753   46.19190     8.1   6.074574 1.022453          ?        ? 
1 1 1   30   21    3 o 14.94308 3.211571   26.79500   261.4   2.435844 0.9322364          ?        ? 
1 1 1   30   21    4 o 24.59984 2.017047   35.85088   293.6   6.194862 0.9923807          ?        ? 
1 1 1   30   21    5 o 12.94829 3.428886   16.11858   315.1   1.864473 0.9021643          ?        ? 
1 1 1   30   21    6 o 7.486330 3.276063   16.24154   200.4      -0.09 0.9322364          ?        ? 
1 1 1   30   21    7 o 20.39302 2.211944   26.03155   284.5   4.300317 0.9021643          ?        ? 
1 1 1   30   21    8 o 8.417517 3.306023   21.25451   320.6  0.5412986 0.8119479          ?        ? 
1 1 1   30   21    9 o 8.553348 3.270017   13.30145   342.0  0.6315150 0.7818757          ?        ? 
1 1 1   30   21   10 o 26.67623 2.705523   39.21488   121.7   7.728541 1.443463          ?        ? 
1 1 1   30   21   11 o 10.82051 4.294421   10.56796    48.6   1.232958 1.383319          ?        ? 
1 1 1   30   22    0 o 39.68245 1.865479   50.68208   180.0   15.99838 1.473535   15.99838 1.473535 
1 1 1   30   22    1 o 23.40890 2.183898   35.10132    37.3   5.623491 1.022453          ?        ? 
1 1 1   30   22    2 o 23.34837 2.125160   39.99344   139.3   5.593419 0.9923807          ?        ? 
1 1 1   30   22    3 o 30.01718 1.703113   52.21561   136.0   9.172004 1.022453          ?        ? 
1 1 1   30   22    4 o 9.416509 3.619724   28.95680   114.5  0.7217315 0.9623086          ?        ? 
1 1 1   30   22    5 o 10.60490 3.692083   11.94435   337.1   1.142741 0.9623086          ?        ? 
1 1 1   30   22    6 o 13.81853 3.393383   15.10027    35.6   2.135122 0.9322364          ?        ? 
1 1 1   30   22    7 o 30.89487 1.606061   44.93512    31.5   9.743376 0.9923807          ?        ? 
1 1 1   30   22    8 f 6.463203 2.961810   14.94514     5.6 -0.4811543 0.8720922          ?        ? 
1 1 1   30   22    9 o 9.510994 3.326391   18.39838    86.1  0.9623086 0.7818757          ?        ? 
1 1 1   30   22   10 o 12.97098 2.961901   5.467977    75.8   1.924617 0.7518036          ?        ? 
1 1 1   30   23    0 o 13.32248 5.357581   11.42810     0.0   2.616277 1.383319   2.616277 1.383319 
1 1 1   30   23    1 o 17.14481 2.631013   19.06324   262.4   3.067359 0.9021643          ?        ? 
1 1 1   30   23    2 o 11.64557 3.922611   13.32070   104.0   1.443463 1.082597          ?        ? 
1 1 1   30   23    3 o 10.32965 3.875050   15.15244    95.5  0.9623086 1.082597          ?        ? 
1 1 1   30   23    4 o 8.175420 3.474039   8.566465   183.1  0.1503607 0.9923807          ?        ? 
1 1 1   30   23    5 o 20.44483 2.500517   26.23363   151.3   4.360461 1.022453          ?        ? 
1 1 1   30   23    6 o 9.576441 3.595221   19.37603     9.4  0.8420200 0.9322364          ?        ? 
1 1 1   30   23    7 o 8.519429 3.469779   4.865526   137.9  0.4510822 0.9322364          ?        ? 
1 1 1   30   23    8 o 11.95041 3.603041   20.49238   121.2   1.653968 0.9322364          ?        ? 
1 1 1   30   23    9 o 11.32120 3.499460   16.19532   227.8   1.503607 0.8720922          ?        ? 
1 1 1   30   24    0 o 37.56529 1.891432   42.14901     0.0   14.37449 1.413391   14.37449 1.413391 
1 1 1   30   24    1 o 8.786218 3.474042   23.17373   185.1  0.5412986 0.9021643          ?        ? 
1 1 1   30   24    2 o 9.092362 3.502769   8.175056    86.0  0.6615872 0.9021643          ?        ? 
1 1 1   30   24    3 o 11.67088 3.867744   15.44087    53.9   1.473535 1.052525          ?        ? 
1 1 1   30   24    4 o 21.37953 2.531854   29.45179    28.7   4.781471 1.082597          ?        ? 
1 1 1   30   24    5 o 10.52116 3.740717   20.64504   349.3   1.142741 0.9923807          ?        ? 
1 1 1   30   24    6 o 10.34576 3.683076   9.349957   229.4   1.112669 0.9623086          ?        ? 
1 1 1   30   24    7 o 10.50040 3.739975   11.20883   216.7   1.172814 0.9923807          ?        ? 
1 1 1   30   24    8 o 9.464851 3.540033   2.824642   162.5  0.9021643 0.9021643          ?        ? 
1 1 1   30   24    9 o 8.909348 3.488133   11.65833    92.7  0.7217315 0.9021643          ?        ? 
1 1 1   30   25    0 o 22.45876 2.961025   14.11865   180.0   5.292697 1.323174   5.292697 1.323174 
1 1 1   30   25    1 o 37.48131 1.444183   44.19322    77.1   14.25420 1.082597          ?        ? 
1 1 1   30   25    2 o 14.13144 3.256712   15.89532   207.3   2.225339 0.9021643          ?        ? 
1 1 1   30   25    3 o 18.17339 2.895786   14.68697   312.9   3.518441 1.052525          ?        ? 
1 1 1   30   25    4 o 9.856658 3.828811   21.18878   265.1  0.8420200 1.082597          ?        ? 
1 1 1   30   25    5 o 13.47661 3.687654   20.54490   106.4   2.105050 1.022453          ?        ? 
1 1 1   30   25    6 o 12.05662 3.801756   22.06064   208.1   1.684040 1.022453          ?        ? 
1 1 1   30   25    7 o 6.299346 2.993001   6.644197   184.9 -0.9923807 1.022453          ?        ? 
1 1 1   30   25    8 o 8.351743 3.477779   16.30786   105.5  0.4210100 0.9623086          ?        ? 
1 1 1   30   26    0 o 4.766872 3.435847   9.968627   360.0  -1.864473 1.443463  -1.864473 1.443463 
1 1 1   30   26    1 o 7.516367 3.328129   9.282413    74.7 -0.1503607 0.9923807          ?        ? 
1 1 1   30   26    2 o 18.87157 2.549626   18.13366     5.3   3.759018 0.9623086          ?        ? 
1 1 1   30   26    3 f 11.14918 3.640029   15.50030   136.2   1.383319 0.9322364          ?        ? 
1 1 1   30   26    4 o 11.49503 3.922612   11.33694    56.6   1.473535 1.082597          ?        ? 
1 1 1   30   26    5 o 14.11011 3.914504   23.21699   141.1   2.375700 1.142741          ?        ? 
1 1 1   30   26    6 o 18.59845 2.991296   29.50295   221.1   3.819162 1.112669          ?        ? 
1 1 1   30   26    7 f 11.73813 3.922607   14.39287     2.5   1.653968 1.082597          ?        ? 
1 1 1   30   27    0 o 39.31119 2.077696   52.91740    -0.0   15.87809 1.623896   15.87809 1.623896 
1 1 1   30   27    1 o 12.29518 3.853353   16.54327    24.0   1.744184 1.052525          ?        ? 
1 1 1   30   27    2 o 16.10279 3.376283   22.59574   171.5   2.947070 1.052525          ?        ? 
1 1 1   30   27    3 o 7.202535 3.250096   3.952290    58.4 -0.3007214 0.9923807          ?        ? 
1 1 1   30   27    4 o 8.107969 3.488186   18.06341   168.8  0.1804329 1.022453          ?        ? 
1 1 1   30   27    5 o 10.29067 3.872155   17.98513    27.3   1.112669 1.082597          ?        ? 
1 1 1   30   27    6 o 11.47151 3.922611   13.58792   108.7   1.563751 1.082597          ?        ? 
1 1 1   30   28    0 o 13.87969 5.586376   28.07733     0.0   2.977142 1.503607   2.977142 1.503607 
1 1 1   30   28    1 o 7.576357 3.321872   9.022871   152.4   0.000000 0.9623086          ?        ? 
1 1 1   30   28    2 o 8.615548 3.519819   10.25655   290.9  0.5112265 0.9623086          ?        ? 
1 1 1   30   28    3 o 8.943056 3.604075   17.64664   327.6  0.6315150 0.9923807          ?        ? 
1 1 1   30   28    4 o 18.14699 2.817142   29.89056   211.3   3.608657 1.022453          ?        ? 
1 1 1   30   28    5 o 12.79267 3.680429   17.99971   135.4   1.984761 0.9923807          ?        ? 
1 1 1   30   29    0 o 14.68654 5.580357   32.10787   180.0   3.277864 1.533679   3.277864 1.533679 
1 1 1   30   29    1 o 6.972865 3.181004   5.570793   181.2 -0.3909379 0.9923807          ?        ? 
1 1 1   30   29    2 f 8.538566 3.600569   17.21168   149.8  0.3909379 1.052525          ?        ? 
1 1 1   30   29    3 o 19.72416 2.668111   28.86736   127.3   4.240172 1.052525          ?        ? 
1 1 1   30   29    4 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   30   30    0 x        ?      ?   6.396959   180.0          ?        ?          ?        ? 
1 1 1   31    0    1 o 15.17479 6.061382   29.95723   270.0   3.277864 1.774257   3.277864 1.774257 
1 1 1   31    0    2 o 29.07527 2.303777   64.91493   270.0   8.660777 1.323174   8.660777 1.323174 
1 1 1   31    0    3 o 6.297163 4.173605   13.59723   270.0 -0.1804329 1.323174 -0.1804329 1.323174 
1 1 1   31    0    4 o 5.830480 4.035131   23.56192   270.0 -0.9322364 1.503607 -0.9322364 1.503607 
1 1 1   31    0    5 o 22.64477 2.912544   43.48487   270.0   5.262625 1.323174   5.262625 1.323174 
1 1 1   31    0    6 o 33.51453 2.356429   66.50025   270.0   11.48756 1.563751   11.48756 1.563751 
1 1 1   31    0    7 o 10.46025 5.129384   25.40714   270.0   1.684040 1.263030   1.684040 1.263030 
1 1 1   31    0    8 o 13.88610 5.069408   20.90204   270.0   2.646349 1.293102   2.646349 1.293102 
1 1 1   31    0    9 o 30.55783 1.934964   55.01410    90.0   9.532870 1.172814   9.532870 1.172814 
1 1 1   31    0   10 o 3.955989 2.856736   13.68243    90.0  -1.473535 1.022453  -1.473535 1.022453 
1 1 1   31    0   11 o 9.938564 6.409549   9.685475    90.0  0.7818757 2.856854  0.7818757 2.856854 
1 1 1   31    0   12 o 9.649250 6.344182   4.047452   270.0  0.5112265 2.977142  0.5112265 2.977142 
1 1 1   31    0   13 o 9.210270 6.115043   8.113953    90.0  0.3909379 2.856854  0.3909379 2.856854 
1 1 1   31    0   14 o 17.01038 8.370486   39.70913   270.0   5.984357 3.368080   5.984357 3.368080 
1 1 1   31    1    0 o 12.85886 5.181495   14.83215     0.0   2.345627 1.293102   2.345627 1.293102 
1 1 1   31    1    1 o 21.40753 2.177357   42.68401    61.2   4.631110 0.9322364          ?        ? 
1 1 1   31    1    2 o 23.87129 1.889643   28.16142    10.2   5.743780 0.9021643          ?        ? 
1 1 1   31    1    3 o 30.44631 1.580337   37.56466   114.8   9.322365 0.9623086          ?        ? 
1 1 1   31    1    4 o 18.50650 2.762416   30.45353   192.5   3.488369 1.022453          ?        ? 
1 1 1   31    1    5 o 11.60568 3.691297   30.17269   112.6   1.383319 0.9623086          ?        ? 
1 1 1   31    1    6 o 9.460781 3.584090   13.20733   143.4  0.6916593 0.9322364          ?        ? 
1 1 1   31    1    7 o 14.98229 3.204443   27.84056   293.9   2.405771 0.9322364          ?        ? 
1 1 1   31    1    8 o 6.914525 3.063134   13.65349   247.9 -0.2405772 0.8420200          ?        ? 
1 1 1   31    1    9 o 21.54369 1.884422   49.31417   104.6   4.721327 0.8119479          ?        ? 
1 1 1   31    1   10 o 10.56328 2.994210   18.87190   249.2   1.202886 0.6615872          ?        ? 
1 1 1   31    1   11 o 12.02351 4.999897   5.172799   236.9  0.9021643 1.984761          ?        ? 
1 1 1   31    1   12 o 10.91831 4.683888   11.67161   260.8  0.4811543 1.834401          ?        ? 
1 1 1   31    1   13 o 19.54793 5.524412   27.76353   264.8   5.082192 2.255411          ?        ? 
1 1 1   31    1   14 o 12.70545 5.058198   30.77026   276.9   1.924617 1.924617          ?        ? 
1 1 1   31    2    0 o 19.28657 3.752543   24.30640    -0.0   4.149956 1.293102   4.149956 1.293102 
1 1 1   31    2    1 f 32.72260 1.562304   48.94334   139.4   10.76583 1.022453          ?        ? 
1 1 1   31    2    2 o 29.02642 1.709444   36.39593   102.2   8.480345 0.9923807          ?        ? 
1 1 1   31    2    3 o 33.89403 1.508308   53.23270    85.4   11.54770 1.022453          ?        ? 
1 1 1   31    2    4 o 14.84830 3.229343   31.55079   206.4   2.345627 0.9322364          ?        ? 
1 1 1   31    2    5 o 16.26295 3.070711   36.52232   225.9   2.796710 0.9623086          ?        ? 
1 1 1   31    2    6 o 8.830996 3.518901   9.969589   304.8  0.4510822 0.9322364          ?        ? 
1 1 1   31    2    7 o 18.94770 2.539381   24.23804   349.7   3.668802 0.9623086          ?        ? 
1 1 1   31    2    8 o 11.11458 3.640029   21.27987   110.4   1.263030 0.9322364          ?        ? 
1 1 1   31    2    9 o 10.79555 3.384653   19.85982   268.8   1.232958 0.8119479          ?        ? 
1 1 1   31    2   10 o 14.33506 3.315122   27.14738   159.8   2.255411 0.9322364          ?        ? 
1 1 1   31    2   11 o 22.65074 1.792321   32.38668   106.7   5.232553 0.8119479          ?        ? 
1 1 1   31    2   12 o 16.85660 4.998608   19.16338   174.6   3.488369 1.804329          ?        ? 
1 1 1   31    2   13 o 15.22437 5.189130   24.27320   225.9   2.947070 1.894545          ?        ? 
1 1 1   31    2   14 o 6.836750 3.337999   10.81156   121.0  -2.165194 1.503607          ?        ? 
1 1 1   31    3    0 o 24.42851 2.509661   43.47775     0.0   6.194862 1.202886   6.194862 1.202886 
1 1 1   31    3    1 o 13.64715 3.419356   23.95463   181.9   1.984761 0.9322364          ?        ? 
1 1 1   31    3    2 o 17.30504 2.519763   24.96371   318.7   3.037287 0.8720922          ?        ? 
1 1 1   31    3    3 o 34.81236 1.468520   53.02806   293.9   12.17922 1.022453          ?        ? 
1 1 1   31    3    4 o 30.18948 1.593782   46.47193   209.3   9.172004 0.9623086          ?        ? 
1 1 1   31    3    5 f 20.44310 2.280077   29.79009   202.6   4.240172 0.9322364          ?        ? 
1 1 1   31    3    6 o 23.92922 2.136411   27.64589   295.1   5.803924 1.022453          ?        ? 
1 1 1   31    3    7 f 8.855897 3.589549   27.91982   329.1  0.3909379 0.9923807          ?        ? 
1 1 1   31    3    8 o 18.71464 2.410318   30.04433   107.2   3.578585 0.9021643          ?        ? 
1 1 1   31    3    9 o 31.30355 1.392961   61.30251    89.1   9.893736 0.8720922          ?        ? 
1 1 1   31    3   10 o 18.39157 2.697922   23.51586   220.7   3.518441 0.9923807          ?        ? 
1 1 1   31    3   11 o 8.621838 3.413564   14.95356   172.5  0.5112265 0.8720922          ?        ? 
1 1 1   31    3   12 o 31.91343 1.790377   46.15595   197.6   10.43503 1.142741          ?        ? 
1 1 1   31    3   13 o 21.68216 4.313978   36.01044   237.0   5.623491 1.804329          ?        ? 
1 1 1   31    3   14 o 18.57946 5.160369   24.55113   222.0   4.751399 1.984761          ?        ? 
1 1 1   31    4    0 o 10.99043 5.320395   23.26500     0.0   1.834401 1.353247   1.834401 1.353247 
1 1 1   31    4    1 o 29.14090 1.599533   40.76258   250.6   8.540489 0.9322364          ?        ? 
1 1 1   31    4    2 o 23.92648 1.948127   33.27447   286.3   5.773852 0.9322364          ?        ? 
1 1 1   31    4    3 o 8.269388 3.462794   7.984215    44.6  0.1503607 0.9623086          ?        ? 
1 1 1   31    4    4 o 37.01026 1.462564   46.97852    22.3   13.77304 1.082597          ?        ? 
1 1 1   31    4    5 o 7.232322 3.257538   2.415958   169.6 -0.4510822 0.9923807          ?        ? 
1 1 1   31    4    6 o 23.17009 2.141513   30.94120   198.7   5.443058 0.9923807          ?        ? 
1 1 1   31    4    7 o 16.05762 3.296974   39.03632    19.2   2.766637 1.022453          ?        ? 
1 1 1   31    4    8 o 6.439636 2.920986   8.920493   237.6 -0.4210100 0.8119479          ?        ? 
1 1 1   31    4    9 o 6.355036 2.800707   15.01087   348.6 -0.1503607 0.6916593          ?        ? 
1 1 1   31    4   10 o 22.50007 2.205284   31.72098   196.4   5.202481 0.9923807          ?        ? 
1 1 1   31    4   11 o 9.297907 3.431390   17.05745   323.2  0.7818757 0.8420200          ?        ? 
1 1 1   31    4   12 o 22.17642 2.712083   40.93016   180.6   5.202481 1.202886          ?        ? 
1 1 1   31    4   13 o 10.81276 3.640029   7.632175    89.5   1.293102 0.9322364          ?        ? 
1 1 1   31    4   14 o 10.34275 4.586632   25.96128   312.7  0.3909379 1.894545          ?        ? 
1 1 1   31    5    0 f 5.466073 3.755732   2.567676   360.0 -0.6916593 1.263030 -0.6916593 1.263030 
1 1 1   31    5    1 f 19.71621 2.440400   27.03459   247.5   3.939451 0.9623086          ?        ? 
1 1 1   31    5    2 o 41.38883 1.344166   70.24649   268.4   17.20127 1.112669          ?        ? 
1 1 1   31    5    3 o 18.26258 2.799311   42.43758    20.2   3.398152 1.022453          ?        ? 
1 1 1   31    5    4 o 17.91133 2.854207   24.90798    18.6   3.277864 1.022453          ?        ? 
1 1 1   31    5    5 o 27.48495 1.969437   46.17796   330.2   7.638325 1.082597          ?        ? 
1 1 1   31    5    6 o 18.60813 2.828133   55.20493   312.9   3.548513 1.052525          ?        ? 
1 1 1   31    5    7 o 26.01476 1.907342   40.29968    98.0   6.856449 0.9923807          ?        ? 
1 1 1   31    5    8 o 22.35254 2.085303   35.16112   199.9   5.082192 0.9322364          ?        ? 
1 1 1   31    5    9 o 8.993968 3.644345   23.48965    65.3  0.4510822 1.022453          ?        ? 
1 1 1   31    5   10 o 8.521456 3.539016   12.67583   122.6  0.3007214 0.9923807          ?        ? 
1 1 1   31    5   11 o 18.98302 2.613863   16.84700    44.4   3.759018 0.9923807          ?        ? 
1 1 1   31    5   12 o 21.36037 2.745302   18.44661   249.5   4.841615 1.172814          ?        ? 
1 1 1   31    5   13 o 10.76735 3.899142   21.50997   317.5   1.232958 1.082597          ?        ? 
1 1 1   31    5   14 o 12.64589 3.619687   13.54815   141.8   1.924617 0.9623086          ?        ? 
1 1 1   31    6    0 o 14.15446 5.349476   12.48471   180.0   2.766637 1.413391   2.766637 1.413391 
1 1 1   31    6    1 f 36.10085 1.624358   71.81023   115.2   13.11145 1.172814          ?        ? 
1 1 1   31    6    2 o 14.45724 3.296145   14.29898    16.6   2.225339 0.9322364          ?        ? 
1 1 1   31    6    3 o 9.737489 3.653328   38.14694   120.0  0.7518036 0.9623086          ?        ? 
1 1 1   31    6    4 o 16.65554 3.276412   23.54809   320.5   2.947070 1.052525          ?        ? 
1 1 1   31    6    5 o 15.98933 3.394005   17.62994   260.2   2.736565 1.052525          ?        ? 
1 1 1   31    6    6 o 54.18521 1.220974   86.57279     3.2   29.50077 1.323174          ?        ? 
1 1 1   31    6    7 o 17.19804 2.710298   19.55207    48.4   3.037287 0.9322364          ?        ? 
1 1 1   31    6    8 o 24.03938 1.876430   44.54810    32.3   5.864068 0.9021643          ?        ? 
1 1 1   31    6    9 o 13.20682 3.641516   19.52096    13.2   1.924617 0.9923807          ?        ? 
1 1 1   31    6   10 o 14.84842 3.323912   27.54310   132.4   2.435844 0.9623086          ?        ? 
1 1 1   31    6   11 o 5.588188 2.696085   4.626484   207.7  -1.293102 0.9021643          ?        ? 
1 1 1   31    6   12 o 8.986513 3.494303   12.07675   220.3  0.6615872 0.9021643          ?        ? 
1 1 1   31    6   13 o 10.60930 3.938664   15.42907     5.2   1.172814 1.112669          ?        ? 
1 1 1   31    6   14 o 20.29314 2.741492   29.56039    77.0   4.510822 1.112669          ?        ? 
1 1 1   31    7    0 o 19.43408 4.348468   21.93606   180.0   4.360461 1.473535   4.360461 1.473535 
1 1 1   31    7    1 o 26.17480 2.010570   35.58714   251.9   6.916593 1.052525          ?        ? 
1 1 1   31    7    2 o 29.65696 1.875899   56.33953   102.6   8.871283 1.112669          ?        ? 
1 1 1   31    7    3 o 30.14252 1.895564   58.21161   212.9   9.172004 1.142741          ?        ? 
1 1 1   31    7    4 o 9.697246 3.850573   12.89872   340.4  0.5713707 1.112669          ?        ? 
1 1 1   31    7    5 o 12.46785 3.908121   24.77534    48.7   1.623896 1.082597          ?        ? 
1 1 1   31    7    6 o 10.91645 3.805217   13.29281   151.5   1.142741 1.022453          ?        ? 
1 1 1   31    7    7 f 10.23502 3.730506   27.38583   350.9  0.9322364 0.9923807          ?        ? 
1 1 1   31    7    8 o 25.23399 1.847184   34.58519    72.3   6.465511 0.9322364          ?        ? 
1 1 1   31    7    9 f 37.53281 1.642507   63.65385    82.3   14.28427 1.232958          ?        ? 
1 1 1   31    7   10 o 9.110603 3.592501   6.587192    98.7  0.6014429 0.9623086          ?        ? 
1 1 1   31    7   11 o 11.51167 3.694331   19.53387   158.5   1.443463 0.9623086          ?        ? 
1 1 1   31    7   12 o 11.95840 3.531553   20.66973   170.1   1.623896 0.9021643          ?        ? 
1 1 1   31    7   13 o 13.98892 4.189070   20.89262   308.6   2.405771 1.263030          ?        ? 
1 1 1   31    7   14 o 5.959272 2.902692   30.35776   141.4  -1.623896 1.112669          ?        ? 
1 1 1   31    8    0 o 63.43075 1.638045   100.7208   180.0   40.44703 2.074978   40.44703 2.074978 
1 1 1   31    8    1 o 34.22772 1.581462   40.44917   120.5   11.78828 1.082597          ?        ? 
1 1 1   31    8    2 o 13.61545 3.511940   19.80791   141.8   1.984761 0.9623086          ?        ? 
1 1 1   31    8    3 o 20.57186 2.411986   36.50323   204.4   4.300317 0.9923807          ?        ? 
1 1 1   31    8    4 o 18.20324 2.973638   22.21041    14.5   3.398152 1.082597          ?        ? 
1 1 1   31    8    5 o 19.24525 2.734506   45.97852    75.4   3.789090 1.052525          ?        ? 
1 1 1   31    8    6 o 19.53832 2.616532   22.92549   167.3   3.909379 1.022453          ?        ? 
1 1 1   31    8    7 o 19.99462 2.481619   21.98118    92.4   4.089812 0.9923807          ?        ? 
1 1 1   31    8    8 o 6.360679 2.802273   6.261346   222.0 -0.1503607 0.6916593          ?        ? 
1 1 1   31    8    9 o 9.744233 3.891845   16.76826   244.4  0.6315150 1.142741          ?        ? 
1 1 1   31    8   10 o 27.93406 2.153080   40.44554   169.5   8.029263 1.202886          ?        ? 
1 1 1   31    8   11 o 14.20529 3.677011   18.88705   121.9   2.285483 1.052525          ?        ? 
1 1 1   31    8   12 o 9.632147 3.725189   19.56412   186.0  0.8119479 1.022453          ?        ? 
1 1 1   31    8   13 o 14.38944 4.090367   17.38558   281.8   2.556132 1.232958          ?        ? 
1 1 1   31    9    0 o 24.54289 3.211815   45.30434    -0.0   6.405366 1.533679   6.405366 1.533679 
1 1 1   31    9    1 o 23.81189 2.210083   28.06417   278.4   5.743780 1.052525          ?        ? 
1 1 1   31    9    2 o 9.555908 3.635186   14.78327    66.8  0.6916593 0.9623086          ?        ? 
1 1 1   31    9    3 o 28.76868 1.881555   35.64641   341.6   8.360056 1.082597          ?        ? 
1 1 1   31    9    4 o 11.30571 3.698274   10.23574   169.7   1.293102 0.9623086          ?        ? 
1 1 1   31    9    5 o 12.87967 3.745661   31.16045   118.5   1.774257 1.022453          ?        ? 
1 1 1   31    9    6 o 23.94366 2.197920   36.64255   332.1   5.833996 1.052525          ?        ? 
1 1 1   31    9    7 o 26.32061 1.999432   37.25954    30.5   7.036882 1.052525          ?        ? 
1 1 1   31    9    8 o 25.87411 1.452811   35.14011   344.7   6.766232 0.7518036          ?        ? 
1 1 1   31    9    9 o 15.82450 3.513143   28.10326    49.1   2.766637 1.082597          ?        ? 
1 1 1   31    9   10 o 32.04894 1.876639   61.22541    45.8   10.49518 1.202886          ?        ? 
1 1 1   31    9   11 o 9.172460 3.738006   10.89707   269.2  0.5112265 1.082597          ?        ? 
1 1 1   31    9   12 o 9.197303 3.741393   10.08147    18.2  0.5713707 1.082597          ?        ? 
1 1 1   31    9   13 o 10.93688 3.640025   20.08583   216.4   1.383319 0.9322364          ?        ? 
1 1 1   31   10    0 o 55.09917 1.640553   86.79564     0.0   30.55330 1.804329   30.55330 1.804329 
1 1 1   31   10    1 o 53.59269 1.206417   88.52608   304.3   28.83919 1.293102          ?        ? 
1 1 1   31   10    2 o 21.96052 2.396403   31.67570   348.7   4.901759 1.052525          ?        ? 
1 1 1   31   10    3 o 13.68765 3.662066   25.00073   112.2   2.014834 1.022453          ?        ? 
1 1 1   31   10    4 o 19.02081 2.687722   26.81097    25.9   3.698874 1.022453          ?        ? 
1 1 1   31   10    5 o 24.02844 2.127589   53.95829   190.3   5.864068 1.022453          ?        ? 
1 1 1   31   10    6 o 14.50541 3.548686   20.92270   269.3   2.285483 1.022453          ?        ? 
1 1 1   31   10    7 o 21.96433 1.916790   26.16127   295.6   4.901759 0.8420200          ?        ? 
1 1 1   31   10    8 o 8.752232 3.239887   10.60084    88.3  0.6615872 0.7518036          ?        ? 
1 1 1   31   10    9 o 9.960993 3.918948   9.636428   136.0  0.7518036 1.142741          ?        ? 
1 1 1   31   10   10 o 7.520460 3.413977   4.003050   228.2 -0.4811543 1.112669          ?        ? 
1 1 1   31   10   11 o 23.68490 2.412384   32.20020   198.3   5.864068 1.142741          ?        ? 
1 1 1   31   10   12 o 10.81032 3.900675   13.12791   100.3   1.232958 1.082597          ?        ? 
1 1 1   31   10   13 f 21.72394 2.422501   25.35172    15.8   5.052120 1.052525          ?        ? 
1 1 1   31   11    0 o 11.88284 5.673614   21.94530   180.0   2.165194 1.533679   2.165194 1.533679 
1 1 1   31   11    1 o 47.91199 1.286690   75.12040   359.6   23.06533 1.232958          ?        ? 
1 1 1   31   11    2 o 6.519270 3.052254   15.24968   153.6 -0.9322364 0.9923807          ?        ? 
1 1 1   31   11    3 o 8.999226 3.578578   31.83294   131.3  0.4811543 0.9623086          ?        ? 
1 1 1   31   11    4 o 11.65989 3.689541   15.23170   298.0   1.413391 0.9623086          ?        ? 
1 1 1   31   11    5 o 6.380810 3.000245   11.55431    85.8  -1.022453 0.9923807          ?        ? 
1 1 1   31   11    6 o 10.93598 3.856002   14.86206    54.6   1.142741 1.052525          ?        ? 
1 1 1   31   11    7 o 27.89324 1.617174   46.84801    87.7   7.878902 0.9021643          ?        ? 
1 1 1   31   11    8 o 5.256410 2.505334  0.7553178   181.3 -0.8720922 0.7217315          ?        ? 
1 1 1   31   11    9 o 11.73898 4.077001   18.36034   324.5   1.443463 1.172814          ?        ? 
1 1 1   31   11   10 o 9.254560 3.873180   13.11676    29.5  0.3608657 1.202886          ?        ? 
1 1 1   31   11   11 o 20.95159 2.870631   32.90075    33.7   4.691255 1.202886          ?        ? 
1 1 1   31   11   12 o 26.11296 2.245654   32.32461   281.2   7.157170 1.172814          ?        ? 
1 1 1   31   11   13 o 7.645372 3.401766   9.559471    34.4      -0.09 1.052525          ?        ? 
1 1 1   31   12    0 o 65.48122 1.517330   109.6130   180.0   43.09338 1.984761   43.09338 1.984761 
1 1 1   31   12    1 o 40.20685 1.458475   54.36983   126.3   16.26903 1.172814          ?        ? 
1 1 1   31   12    2 o 40.98752 1.394012   55.34478    72.0   16.90055 1.142741          ?        ? 
1 1 1   31   12    3 o 24.47239 2.088993   38.86271   214.2   6.074574 1.022453          ?        ? 
1 1 1   31   12    4 o 18.14884 2.982553   23.12487   206.7   3.398152 1.082597          ?        ? 
1 1 1   31   12    5 o 17.61283 2.731840   19.78297   296.0   3.187647 0.9623086          ?        ? 
1 1 1   31   12    6 o 19.76711 2.358050   27.24998   105.2   3.999595 0.9322364          ?        ? 
1 1 1   31   12    7 o 14.05038 2.979928   22.17023   136.5   2.135122 0.8119479          ?        ? 
1 1 1   31   12    8 o 10.30832 3.332218   5.689542   133.1   1.112669 0.7818757          ?        ? 
1 1 1   31   12    9 o 7.878930 3.545454   13.84819    59.2 -0.3909379 1.172814          ?        ? 
1 1 1   31   12   10 o 16.51501 3.960163   13.94519    13.5   3.127503 1.293102          ?        ? 
1 1 1   31   12   11 o 19.43078 3.095310   25.56299   233.1   4.089812 1.202886          ?        ? 
1 1 1   31   12   12 o 8.605028 3.719314   20.83245   239.0  0.2105050 1.172814          ?        ? 
1 1 1   31   12   13 o 11.08939 4.099542   14.67933    44.4   1.413391 1.202886          ?        ? 
1 1 1   31   13    0 o 8.945944 5.072305   13.71570   360.0   1.142741 1.383319   1.142741 1.383319 
1 1 1   31   13    1 o 10.78271 3.749775   21.75834   293.8   1.112669 0.9923807          ?        ? 
1 1 1   31   13    2 o 20.32898 2.366840   26.15888   178.1   4.210100 0.9623086          ?        ? 
1 1 1   31   13    3 o 15.99126 3.215965   20.19539   118.1   2.736565 0.9923807          ?        ? 
1 1 1   31   13    4 o 24.88871 1.993636   50.00010   160.2   6.285078 0.9923807          ?        ? 
1 1 1   31   13    5 o 25.00928 2.224513   23.53629   311.8   6.375295 1.112669          ?        ? 
1 1 1   31   13    6 o 16.62854 2.622276   27.72024   209.4   2.856854 0.8720922          ?        ? 
1 1 1   31   13    7 o 9.696641 3.500752   18.79888   181.2  0.8720922 0.8720922          ?        ? 
1 1 1   31   13    8 o 17.90919 2.266847   21.48463   183.9   3.307936 0.8119479          ?        ? 
1 1 1   31   13    9 o 11.20795 4.149052   19.23555   209.8   1.202886 1.232958          ?        ? 
1 1 1   31   13   10 f 13.00177 4.236904   27.57601   226.2   1.924617 1.263030          ?        ? 
1 1 1   31   13   11 o 8.071005 3.633373   15.74576   194.6 -0.3007214 1.232958          ?        ? 
1 1 1   31   13   12 o 10.67176 4.062920   14.94266   215.8   1.202886 1.202886          ?        ? 
1 1 1   31   14    0 o 44.52739 1.898466   60.09498    -0.0   20.05812 1.684040   20.05812 1.684040 
1 1 1   31   14    1 o 22.70710 2.052742   32.47416   330.1   5.232553 0.9322364          ?        ? 
1 1 1   31   14    2 o 28.68772 1.834452   54.12205   346.1   8.329985 1.052525          ?        ? 
1 1 1   31   14    3 o 24.42689 2.215995   32.75407   345.8   6.074574 1.082597          ?        ? 
1 1 1   31   14    4 o 15.51643 3.209718   30.81697   109.6   2.586205 0.9623086          ?        ? 
1 1 1   31   14    5 o 8.421378 3.418879   14.21478   221.1  0.3608657 0.9021643          ?        ? 
1 1 1   31   14    6 o 28.87708 1.614146   41.13090    10.8   8.450273 0.9322364          ?        ? 
1 1 1   31   14    7 o 10.72979 3.520652   11.95751   112.7   1.202886 0.8720922          ?        ? 
1 1 1   31   14    8 o 27.69385 1.574523   32.23740     4.4   7.788685 0.8720922          ?        ? 
1 1 1   31   14    9 o 23.07674 2.606273   35.37646   272.8   5.563347 1.202886          ?        ? 
1 1 1   31   14   10 o 21.23898 3.114968   25.93468   334.3   4.871688 1.323174          ?        ? 
1 1 1   31   14   11 o 11.16988 4.103632   27.21001   103.6   1.323174 1.202886          ?        ? 
1 1 1   31   14   12 f 8.074866 3.634337   11.43148   247.2 -0.1804329 1.232958          ?        ? 
1 1 1   31   15    0 f 8.069088 4.703053   5.388414   180.0  0.8720922 1.232958  0.8720922 1.232958 
1 1 1   31   15    1 o 19.08867 2.520627   22.12216    60.3   3.728946 0.9623086          ?        ? 
1 1 1   31   15    2 o 21.08132 2.425021   37.69818   353.0   4.540894 1.022453          ?        ? 
1 1 1   31   15    3 o 9.894382 3.710411   25.12343   149.1  0.8119479 0.9923807          ?        ? 
1 1 1   31   15    4 o 12.17145 3.658887   25.27524   326.3   1.593824 0.9623086          ?        ? 
1 1 1   31   15    5 o 8.149946 3.343706   10.42560    89.0  0.3007214 0.8720922          ?        ? 
1 1 1   31   15    6 o 23.42526 1.925623   35.68637    37.6   5.593419 0.9021643          ?        ? 
1 1 1   31   15    7 f 17.78225 2.452143   33.85220   208.6   3.277864 0.8720922          ?        ? 
1 1 1   31   15    8 o 11.26048 3.356037   11.64629   192.6   1.383319 0.8119479          ?        ? 
1 1 1   31   15    9 o 20.00701 3.231622   21.05626   304.5   4.300317 1.293102          ?        ? 
1 1 1   31   15   10 f 9.724391 4.012557   11.53613   227.4  0.6014429 1.263030          ?        ? 
1 1 1   31   15   11 o 13.77918 4.141456   28.57079   150.7   2.315555 1.232958          ?        ? 
1 1 1   31   15   12 o 16.23040 3.851207   22.88612   220.5   3.217719 1.232958          ?        ? 
1 1 1   31   16    0 o 9.322301 5.038640   17.52461     0.0   1.323174 1.293102   1.323174 1.293102 
1 1 1   31   16    1 f 8.663438 3.526347   3.834417   142.9  0.3608657 0.9623086          ?        ? 
1 1 1   31   16    2 o 39.85233 1.509179   64.14327   143.4   16.02845 1.202886          ?        ? 
1 1 1   31   16    3 o 18.74583 2.807358   32.32283   135.1   3.638730 1.052525          ?        ? 
1 1 1   31   16    4 o 14.41594 3.113196   22.87896    64.6   2.255411 0.8720922          ?        ? 
1 1 1   31   16    5 o 6.222829 2.921464   15.05436   236.6 -0.9021643 0.9322364          ?        ? 
1 1 1   31   16    6 o 21.39207 2.108642   41.71484    64.4   4.691255 0.9021643          ?        ? 
1 1 1   31   16    7 o 6.975101 3.125154   5.401658    89.5 -0.3007214 0.9021643          ?        ? 
1 1 1   31   16    8 o 9.684361 3.389496   28.30914   216.4  0.9322364 0.8119479          ?        ? 
1 1 1   31   16    9 o 8.982574 3.894242   9.642190   192.2  0.1202886 1.293102          ?        ? 
1 1 1   31   16   10 o 11.50044 4.206928   28.69621   105.8   1.413391 1.263030          ?        ? 
1 1 1   31   16   11 o 7.850863 3.583781   12.75944   330.2 -0.4210100 1.263030          ?        ? 
1 1 1   31   16   12 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   31   17    0 o 11.34743 5.728475   14.78654   180.0   2.044906 1.593824   2.044906 1.593824 
1 1 1   31   17    1 o 14.58927 3.702590   13.40811   150.0   2.345627 1.082597          ?        ? 
1 1 1   31   17    2 f 15.63685 3.457691   25.32366    93.2   2.676421 1.052525          ?        ? 
1 1 1   31   17    3 o 11.31862 3.812093   23.49527    62.9   1.323174 1.022453          ?        ? 
1 1 1   31   17    4 o 11.86578 3.382577   19.64548   111.1   1.533679 0.8420200          ?        ? 
1 1 1   31   17    5 o 31.30061 1.537205   44.63081   251.5   9.923808 0.9623086          ?        ? 
1 1 1   31   17    6 o 26.34241 1.712380   42.99461   254.9   7.066954 0.9021643          ?        ? 
1 1 1   31   17    7 o 6.533462 3.001719   11.36568    30.6 -0.5713707 0.9021643          ?        ? 
1 1 1   31   17    8 o 20.33460 2.144356   28.96470   253.8   4.270245 0.8720922          ?        ? 
1 1 1   31   17    9 o 17.54421 3.874634   13.93864   155.8   3.578585 1.323174          ?        ? 
1 1 1   31   17   10 o 14.87842 4.110713   15.32995    25.8   2.676421 1.263030          ?        ? 
1 1 1   31   17   11 o 10.54640 4.162609   19.03140   215.3   1.112669 1.293102          ?        ? 
1 1 1   31   18    0 o 24.45996 3.299703   37.75782    -0.0   6.285078 1.593824   6.285078 1.593824 
1 1 1   31   18    1 o 8.303988 3.498653   18.85766   174.7  0.1804329 0.9923807          ?        ? 
1 1 1   31   18    2 o 22.83548 2.502118   39.99056    41.7   5.382914 1.142741          ?        ? 
1 1 1   31   18    3 o 17.20927 2.621158   26.67305    57.4   3.067359 0.9021643          ?        ? 
1 1 1   31   18    4 o 7.517193 3.282918   2.694466    33.9      -0.09 0.9322364          ?        ? 
1 1 1   31   18    5 o 12.22148 3.506886   21.43605    96.3   1.653968 0.9021643          ?        ? 
1 1 1   31   18    6 o 17.72968 2.629027   19.22742   303.4   3.277864 0.9322364          ?        ? 
1 1 1   31   18    7 o 8.665937 3.374550   11.12730   183.5  0.5713707 0.8420200          ?        ? 
1 1 1   31   18    8 o 8.682794 3.375898   13.54140   222.5  0.6014429 0.8420200          ?        ? 
1 1 1   31   18    9 o 5.876314 2.800856   6.834185    53.6 -0.9923807 0.9021643          ?        ? 
1 1 1   31   18   10 o 32.63710 2.211384   47.84233   197.7   11.24698 1.443463          ?        ? 
1 1 1   31   18   11 o 13.20587 4.336610   17.33595   210.9   2.225339 1.323174          ?        ? 
1 1 1   31   19    0 o 9.245874 5.203776   21.14921     0.0   1.293102 1.443463   1.293102 1.443463 
1 1 1   31   19    1 o 7.474392 3.361326   11.52932    65.9 -0.3909379 1.052525          ?        ? 
1 1 1   31   19    2 o 38.19346 1.377886   58.42310   307.2   14.73535 1.052525          ?        ? 
1 1 1   31   19    3 o 17.52422 2.574050   16.96863   296.0   3.187647 0.9021643          ?        ? 
1 1 1   31   19    4 o 7.423772 3.235934   22.45069   291.2      -0.06 0.9021643          ?        ? 
1 1 1   31   19    5 f 16.86013 2.764619   31.43606    86.0   2.977142 0.9322364          ?        ? 
1 1 1   31   19    6 o 8.638646 3.488290   12.79769   268.5  0.4510822 0.9322364          ?        ? 
1 1 1   31   19    7 o 4.995367 2.460330   8.494040   101.0  -1.744184 0.8720922          ?        ? 
1 1 1   31   19    8 o 17.72661 2.459839   21.19217   356.1   3.307936 0.8720922          ?        ? 
1 1 1   31   19    9 o 16.95134 2.394938   20.26325    79.1   3.037287 0.8119479          ?        ? 
1 1 1   31   19   10 o 19.67118 3.652891   24.50506   102.9   4.570966 1.383319          ?        ? 
1 1 1   31   20    0 o 14.15691 5.349142   5.177832   180.0   2.856854 1.413391   2.856854 1.413391 
1 1 1   31   20    1 o 12.35997 3.782796   19.46501    17.0   1.684040 1.022453          ?        ? 
1 1 1   31   20    2 o 8.078843 3.426500   16.63855    50.2  0.1503607 0.9623086          ?        ? 
1 1 1   31   20    3 o 8.407564 3.416994   3.711167   142.8  0.3909379 0.9021643          ?        ? 
1 1 1   31   20    4 o 20.68171 2.326473   30.97858    16.0   4.420605 0.9623086          ?        ? 
1 1 1   31   20    5 o 13.33172 3.465036   26.41095   116.4   1.984761 0.9322364          ?        ? 
1 1 1   31   20    6 o 18.87134 2.549656   27.31362   236.4   3.728946 0.9623086          ?        ? 
1 1 1   31   20    7 o 14.15031 3.253765   27.44580    18.9   2.255411 0.9021643          ?        ? 
1 1 1   31   20    8 o 7.651568 3.223197   11.83088   263.0  0.2105050 0.8420200          ?        ? 
1 1 1   31   20    9 o 11.37668 3.347334   10.42164   104.9   1.503607 0.8119479          ?        ? 
1 1 1   31   20   10 o 8.250237 3.717121   9.673504   316.6 -0.1503607 1.293102          ?        ? 
1 1 1   31   21    0 o 24.00744 3.796441   37.23102    -0.0   6.315150 1.714112   6.315150 1.714112 
1 1 1   31   21    1 f 7.886004 3.415066   20.13535   335.0   0.000000 0.9923807          ?        ? 
1 1 1   31   21    2 o 31.76923 1.609187   42.37187    59.3   10.25460 1.022453          ?        ? 
1 1 1   31   21    3 o 7.600214 3.300891   9.574163   228.7      -0.03 0.9322364          ?        ? 
1 1 1   31   21    4 o 20.85388 2.379367   28.88157    15.7   4.510822 0.9923807          ?        ? 
1 1 1   31   21    5 f 13.35623 3.543363   19.51539   189.4   2.014834 0.9623086          ?        ? 
1 1 1   31   21    6 o 8.764754 3.509314   16.62148    19.1  0.5412986 0.9322364          ?        ? 
1 1 1   31   21    7 o 8.656325 3.491237   9.205024   216.9  0.5112265 0.9322364          ?        ? 
1 1 1   31   21    8 o 30.42393 1.581499   45.47177   106.9   9.502798 0.9623086          ?        ? 
1 1 1   31   21    9 o 12.76528 3.186743   19.04367   261.6   1.894545 0.8119479          ?        ? 
1 1 1   31   22    0 o 23.63013 2.937720   39.20047   180.0   5.984357 1.353247   5.984357 1.353247 
1 1 1   31   22    1 o 6.055730 2.898506   7.281367   174.1  -1.232958 0.9923807          ?        ? 
1 1 1   31   22    2 o 13.69166 3.582750   24.46809   316.0   2.105050 0.9923807          ?        ? 
1 1 1   31   22    3 o 15.07957 3.545587   20.40104    40.9   2.556132 1.052525          ?        ? 
1 1 1   31   22    4 o 9.652173 3.685780   22.13156   102.1  0.8119479 0.9923807          ?        ? 
1 1 1   31   22    5 o 8.198256 3.419013   12.31861   185.7  0.3007214 0.9322364          ?        ? 
1 1 1   31   22    6 o 15.42436 3.405592   17.32620    88.8   2.706493 1.022453          ?        ? 
1 1 1   31   22    7 o 9.365516 3.573500   21.37773    45.4  0.8119479 0.9322364          ?        ? 
1 1 1   31   22    8 o 8.073472 3.364967   15.76408   164.1  0.3608657 0.9021643          ?        ? 
1 1 1   31   22    9 o 19.10142 2.204077   29.79850   165.0   3.879307 0.8420200          ?        ? 
1 1 1   31   23    0 o 23.05235 3.200546   27.37718   180.0   5.653563 1.443463   5.653563 1.443463 
1 1 1   31   23    1 o 8.055474 3.392320   14.98319   211.1  0.2105050 0.9322364          ?        ? 
1 1 1   31   23    2 o 31.68790 1.803120   45.23686   247.8   10.28467 1.142741          ?        ? 
1 1 1   31   23    3 o 20.12261 2.615279   24.70596   279.7   4.270245 1.052525          ?        ? 
1 1 1   31   23    4 o 10.57433 3.742616   21.17797   251.7   1.172814 0.9923807          ?        ? 
1 1 1   31   23    5 o 10.17661 3.776095   14.15619    90.5   1.022453 1.022453          ?        ? 
1 1 1   31   23    6 o 11.55551 3.627468   19.00276   289.4   1.533679 0.9322364          ?        ? 
1 1 1   31   23    7 o 18.23097 2.556738   26.47447   121.7   3.578585 0.9322364          ?        ? 
1 1 1   31   23    8 o 8.179870 3.384313   1.158246    78.5  0.4210100 0.9021643          ?        ? 
1 1 1   31   24    0 o 16.65091 4.794890   22.03029    -0.0   3.578585 1.383319   3.578585 1.383319 
1 1 1   31   24    1 o 23.24686 2.199120   32.36476   236.3   5.623491 1.022453          ?        ? 
1 1 1   31   24    2 f 5.937190 2.844764   10.59469   294.1  -1.172814 0.9623086          ?        ? 
1 1 1   31   24    3 o 11.60485 3.922613   12.13389   101.1   1.503607 1.082597          ?        ? 
1 1 1   31   24    4 o 20.23284 2.675347   18.65425     3.3   4.360461 1.082597          ?        ? 
1 1 1   31   24    5 o 9.113442 3.630894   8.704213   140.2  0.6615872 0.9923807          ?        ? 
1 1 1   31   24    6 o 12.55682 3.770842   14.05317    51.8   1.894545 1.022453          ?        ? 
1 1 1   31   24    7 o 8.766585 3.576771   15.51402    63.4  0.5713707 0.9923807          ?        ? 
1 1 1   31   25    0 o 6.520626 4.301143   6.074569     0.0       0.03 1.383319       0.03 1.383319 
1 1 1   31   25    1 o 24.15853 1.991654   34.44735   295.4   6.044501 0.9623086          ?        ? 
1 1 1   31   25    2 o 14.37397 3.483463   22.47033   136.0   2.375700 0.9923807          ?        ? 
1 1 1   31   25    3 o 22.07812 2.247430   28.68318    14.5   5.112265 0.9923807          ?        ? 
1 1 1   31   25    4 o 25.57364 2.116627   39.99839   152.0   6.856449 1.082597          ?        ? 
1 1 1   31   25    5 o 6.174507 2.940776   9.226492   296.5 -0.9923807 0.9923807          ?        ? 
1 1 1   31   25    6 o 11.38066 3.867750   18.94774   179.3   1.533679 1.052525          ?        ? 
1 1 1   31   26    0 o 46.65943 1.843077   63.21272   180.0   22.25339 1.714112   22.25339 1.714112 
1 1 1   31   26    1 o 30.70734 1.860697   32.38939   133.6   9.773447 1.142741          ?        ? 
1 1 1   31   26    2 o 11.48079 3.812089   13.60061   350.0   1.533679 1.022453          ?        ? 
1 1 1   31   26    3 o 16.94544 3.038290   22.01588   216.3   3.247792 0.9923807          ?        ? 
1 1 1   31   26    4 o 8.879261 3.692543   1.968467   108.5  0.5112265 1.082597          ?        ? 
1 1 1   31   26    5 o 8.001642 3.491445   14.17136   277.1  0.1202886 1.052525          ?        ? 
1 1 1   31   27    0 o 7.751956 4.886039  0.2933370     0.0  0.6916593 1.563751  0.6916593 1.563751 
1 1 1   31   27    1 o 10.36949 3.785913   15.49035   258.8   1.172814 1.022453          ?        ? 
1 1 1   31   27    2 o 29.07976 1.861427   39.00364   258.2   8.811138 1.082597          ?        ? 
1 1 1   31   27    3 o 12.78555 3.754486   8.798673   240.9   1.984761 1.022453          ?        ? 
1 1 1   31   27    4 o 10.05167 3.766841   16.60400   311.2   1.082597 1.022453          ?        ? 
1 1 1   31   28    0 o 5.897989 3.983972   19.18189     0.0 -0.2405772 1.323174 -0.2405772 1.323174 
1 1 1   31   28    1 o 10.29653 3.783306   9.510505   245.5   1.172814 1.022453          ?        ? 
1 1 1   32    0    0 o 50.08804 2.352611   95.47611     0.0   25.35082 2.345627   25.35082 2.345627 
1 1 1   32    0    1 o 14.86563 4.911709   25.14116     0.0   2.886926 1.293102   2.886926 1.293102 
1 1 1   32    0    2 o 25.11330 3.309570   34.42340   180.0   6.525656 1.653968   6.525656 1.653968 
1 1 1   32    0    3 o 9.891707 5.507892   25.12468     0.0   1.443463 1.593824   1.443463 1.593824 
1 1 1   32    0    4 o 10.90827 5.364946   24.10415     0.0   1.834401 1.383319   1.834401 1.383319 
1 1 1   32    0    5 o 39.52851 2.104712   64.84406     0.0   15.87809 1.653968   15.87809 1.653968 
1 1 1   32    0    6 o 6.779121 4.459440  0.8561357   180.0      -0.06 1.473535      -0.06 1.473535 
1 1 1   32    0    7 o 11.34245 5.282745   1.851358     0.0   1.984761 1.323174   1.984761 1.323174 
1 1 1   32    0    8 o 12.41042 5.211823   10.30447   180.0   2.285483 1.293102   2.285483 1.293102 
1 1 1   32    0    9 o 6.971037 4.325702   24.09711   180.0  0.4811543 1.172814  0.4811543 1.172814 
1 1 1   32    0   10 o 9.919516 4.929811   24.07267   180.0   1.563751 1.172814   1.563751 1.172814 
1 1 1   32    0   11 o 5.676599 4.073311   5.230836   180.0  -2.225339 1.954689  -2.225339 1.954689 
1 1 1   32    0   12 o 9.766873 6.403275   26.29572     0.0  0.8119479 3.007215  0.8119479 3.007215 
1 1 1   32    0   13 o 10.20568 6.638245   6.626600   180.0   1.443463 3.157575   1.443463 3.157575 
1 1 1   32    1    0 o 31.52887 2.264876   32.11686    -0.0   10.16438 1.413391   10.16438 1.413391 
1 1 1   32    1    1 o 23.24470 2.134639   30.50338    29.4   5.473131 0.9923807          ?        ? 
1 1 1   32    1    2 o 19.06547 2.996888   36.76188   105.3   3.728946 1.142741          ?        ? 
1 1 1   32    1    3 o 13.39600 3.770056   14.42574   219.6   1.924617 1.052525          ?        ? 
1 1 1   32    1    4 f 10.86488 3.640027   10.33805   353.2   1.172814 0.9322364          ?        ? 
1 1 1   32    1    5 o 15.79914 3.251981   35.27537    72.9   2.676421 0.9923807          ?        ? 
1 1 1   32    1    6 o 18.25191 2.800948   39.07581    47.0   3.428224 1.022453          ?        ? 
1 1 1   32    1    7 o 8.523861 3.470383   24.34074   188.6  0.3608657 0.9322364          ?        ? 
1 1 1   32    1    8 o 7.840667 3.321192   11.32676   110.8  0.1202886 0.9021643          ?        ? 
1 1 1   32    1    9 f 6.679253 3.043262   15.57121    76.7 -0.4811543 0.9021643          ?        ? 
1 1 1   32    1   10 o 17.48725 1.891627   23.84632   328.8   3.127503 0.6615872          ?        ? 
1 1 1   32    1   11 o 12.19151 4.905503   26.43159   290.1   1.323174 1.834401          ?        ? 
1 1 1   32    1   12 f 10.11187 4.684832   23.64502   198.6 -0.7818757 2.255411          ?        ? 
1 1 1   32    1   13 o 11.04584 4.750049   8.409040    44.7  0.9021643 1.894545          ?        ? 
1 1 1   32    2    0 o 22.77267 3.177375   38.37926   180.0   5.412986 1.413391   5.412986 1.413391 
1 1 1   32    2    1 o 15.14647 3.535450   35.53762   231.9   2.465916 1.052525          ?        ? 
1 1 1   32    2    2 o 18.87646 2.708275   41.72998   114.2   3.638730 1.022453          ?        ? 
1 1 1   32    2    3 o 14.07153 3.693226   39.03390   173.7   2.135122 1.052525          ?        ? 
1 1 1   32    2    4 o 16.89172 3.230840   35.51347   319.0   3.037287 1.052525          ?        ? 
1 1 1   32    2    5 o 10.83808 3.640028   18.65380   184.4   1.172814 0.9322364          ?        ? 
1 1 1   32    2    6 o 23.12105 2.211087   34.64830   170.1   5.443058 1.022453          ?        ? 
1 1 1   32    2    7 o 6.757380 3.139745   3.312824   287.7 -0.8119479 1.022453          ?        ? 
1 1 1   32    2    8 o 13.97176 3.705315   24.14515    70.9   2.165194 1.052525          ?        ? 
1 1 1   32    2    9 o 34.34419 1.400977   50.25937   270.8   11.93864 0.9623086          ?        ? 
1 1 1   32    2   10 o 12.41774 3.641081   15.42957   122.7   1.714112 0.9623086          ?        ? 
1 1 1   32    2   11 f 5.275028 2.536355   7.557623   238.2  -1.052525 0.7818757          ?        ? 
1 1 1   32    2   12 o 13.40140 5.128403   5.025361   214.4   2.074978 1.924617          ?        ? 
1 1 1   32    2   13 o 13.74009 5.131790   15.04526    61.9   2.495988 1.894545          ?        ? 
1 1 1   32    3    0 o 38.90458 1.825079   66.37863   180.0   15.30672 1.413391   15.30672 1.413391 
1 1 1   32    3    1 o 18.95733 2.696722   33.79172   187.1   3.668802 1.022453          ?        ? 
1 1 1   32    3    2 o 25.83991 1.745680   44.02808   262.7   6.736160 0.9021643          ?        ? 
1 1 1   32    3    3 o 22.74057 1.983601   34.13362   298.6   5.232553 0.9021643          ?        ? 
1 1 1   32    3    4 o 10.68994 3.746677   18.15547    68.3   1.082597 0.9923807          ?        ? 
1 1 1   32    3    5 o 16.36436 3.144324   35.99893    15.6   2.856854 0.9923807          ?        ? 
1 1 1   32    3    6 o 9.170691 3.772079   10.03852   359.1  0.3608657 1.112669          ?        ? 
1 1 1   32    3    7 o 21.82221 2.204883   38.56947   236.4   4.871688 0.9623086          ?        ? 
1 1 1   32    3    8 o 16.70037 3.087300   29.20153   209.8   3.007215 0.9923807          ?        ? 
1 1 1   32    3    9 o 13.84580 3.116053   13.78354   300.1   2.105050 0.8420200          ?        ? 
1 1 1   32    3   10 o 11.08672 3.755617   19.91246   352.9   1.293102 0.9923807          ?        ? 
1 1 1   32    3   11 o 10.22798 3.459420   10.45663   163.5   1.112669 0.8420200          ?        ? 
1 1 1   32    3   12 o 18.76464 2.964803   31.60339     5.8   3.819162 1.112669          ?        ? 
1 1 1   32    3   13 o 16.73156 4.552606   23.08443   303.7   3.638730 1.563751          ?        ? 
1 1 1   32    4    0 o 22.95845 3.100658   41.11255   180.0   5.623491 1.383319   5.623491 1.383319 
1 1 1   32    4    1 o 8.400471 3.453563   21.98488    93.0  0.2706493 0.9322364          ?        ? 
1 1 1   32    4    2 o 27.10439 1.941614   45.19334   276.1   7.427820 1.052525          ?        ? 
1 1 1   32    4    3 o 16.76782 3.073819   20.65961     3.5   2.977142 0.9923807          ?        ? 
1 1 1   32    4    4 o 14.34003 3.573746   27.76015   328.3   2.225339 1.022453          ?        ? 
1 1 1   32    4    5 o 7.045559 3.239192   10.18337   139.2 -0.7217315 1.052525          ?        ? 
1 1 1   32    4    6 o 23.84464 2.333165   29.02466    74.5   5.803924 1.112669          ?        ? 
1 1 1   32    4    7 o 19.71570 2.745520   34.72829   245.0   4.029667 1.082597          ?        ? 
1 1 1   32    4    8 o 17.27413 2.698359   38.32379   315.1   3.097431 0.9322364          ?        ? 
1 1 1   32    4    9 o 21.20719 1.914322   33.57212   300.4   4.601038 0.8119479          ?        ? 
1 1 1   32    4   10 o 9.681750 3.554149   26.27868     2.1  0.8720922 0.9021643          ?        ? 
1 1 1   32    4   11 o 13.47042 3.529526   9.140526   181.3   2.074978 0.9623086          ?        ? 
1 1 1   32    4   12 o 10.07201 3.967784   20.53535   202.5  0.9021643 1.172814          ?        ? 
1 1 1   32    4   13 o 23.17589 2.270733   39.87207   117.7   5.713707 1.052525          ?        ? 
1 1 1   32    5    0 o 13.64040 5.183406   12.39734     0.0   2.586205 1.323174   2.586205 1.323174 
1 1 1   32    5    1 o 15.84728 3.242961   25.81037   319.2   2.676421 0.9923807          ?        ? 
1 1 1   32    5    2 o 27.29564 2.093267   43.93799   128.1   7.548109 1.142741          ?        ? 
1 1 1   32    5    3 o 23.29341 2.130175   35.39330   227.8   5.503202 0.9923807          ?        ? 
1 1 1   32    5    4 o 15.78018 3.341900   31.60039   129.4   2.676421 1.022453          ?        ? 
1 1 1   32    5    5 o 9.338540 3.613483   8.368610   355.2  0.6315150 0.9623086          ?        ? 
1 1 1   32    5    6 o 20.35334 2.437882   41.99027   177.7   4.240172 0.9923807          ?        ? 
1 1 1   32    5    7 o 8.231907 3.512994   25.19236   260.0       0.09 1.022453          ?        ? 
1 1 1   32    5    8 o 8.078755 3.396754   14.71244   276.4  0.1804329 0.9322364          ?        ? 
1 1 1   32    5    9 o 6.258442 2.773873   4.036879   254.4 -0.1804329 0.6916593          ?        ? 
1 1 1   32    5   10 o 20.28566 2.594260   35.86813    20.7   4.300317 1.052525          ?        ? 
1 1 1   32    5   11 f 4.988107 2.473995   8.477711   138.6  -2.044906 0.9322364          ?        ? 
1 1 1   32    5   12 o 7.364807 3.136361   12.77850   292.5  0.1503607 0.8119479          ?        ? 
1 1 1   32    5   13 o 19.80089 2.885581   18.89385   347.1   4.330389 1.142741          ?        ? 
1 1 1   32    6    0 o 29.23807 2.771786   32.71926   180.0   8.871283 1.593824   8.871283 1.593824 
1 1 1   32    6    1 o 7.156191 3.305906   13.93294    81.0 -0.8420200 1.112669          ?        ? 
1 1 1   32    6    2 o 26.22298 2.178893   48.08309   163.4   6.976738 1.142741          ?        ? 
1 1 1   32    6    3 o 10.09596 3.725331   11.88422    73.0  0.8720922 0.9923807          ?        ? 
1 1 1   32    6    4 o 6.099432 2.924866   20.05398   124.4  -1.383319 1.022453          ?        ? 
1 1 1   32    6    5 o 20.51693 2.418443   40.69370   126.5   4.300317 0.9923807          ?        ? 
1 1 1   32    6    6 o 10.96367 3.906147   25.50121   166.4   1.142741 1.082597          ?        ? 
1 1 1   32    6    7 o 19.67694 2.827344   31.79974   158.5   4.029667 1.112669          ?        ? 
1 1 1   32    6    8 o 19.67981 2.444913   37.80497   349.8   3.999595 0.9623086          ?        ? 
1 1 1   32    6    9 o 13.38698 3.912005   21.69052   282.6   2.014834 1.112669          ?        ? 
1 1 1   32    6   10 f 13.14528 3.793068   15.67086    54.6   1.954689 1.052525          ?        ? 
1 1 1   32    6   11 o 7.128065 3.209342   7.163567    98.2 -0.3007214 0.9623086          ?        ? 
1 1 1   32    6   12 o 9.237735 3.426944   10.47940    37.7  0.8420200 0.8420200          ?        ? 
1 1 1   32    6   13 o 8.706931 3.660642   16.62231   121.6  0.4510822 1.082597          ?        ? 
1 1 1   32    7    0 o 11.55050 5.505395   11.33148     0.0   2.044906 1.443463   2.044906 1.443463 
1 1 1   32    7    1 o 15.58225 3.551615   18.01779   208.9   2.616277 1.082597          ?        ? 
1 1 1   32    7    2 o 15.66507 3.538679   26.00189    65.0   2.646349 1.082597          ?        ? 
1 1 1   32    7    3 o 29.67885 2.026503   45.29234   311.9   8.931427 1.202886          ?        ? 
1 1 1   32    7    4 o 15.28678 3.429121   14.30950   226.5   2.526060 1.022453          ?        ? 
1 1 1   32    7    5 o 29.37497 1.945094   45.05163    83.6   8.750995 1.142741          ?        ? 
1 1 1   32    7    6 o 13.54576 3.897112   20.98185   145.2   2.014834 1.112669          ?        ? 
1 1 1   32    7    7 o 8.858903 3.625175   9.963094   165.1  0.3909379 1.022453          ?        ? 
1 1 1   32    7    8 o 7.686843 3.290745   24.46910   260.7       0.06 0.9021643          ?        ? 
1 1 1   32    7    9 o 9.355976 3.698692   26.00743    20.8  0.6315150 1.022453          ?        ? 
1 1 1   32    7   10 o 10.97323 3.906488   24.62968    12.2   1.232958 1.082597          ?        ? 
1 1 1   32    7   11 o 21.54469 2.372865   18.03875   149.3   4.871688 1.022453          ?        ? 
1 1 1   32    7   12 o 7.925067 3.367371   10.80473    35.0  0.2405772 0.9322364          ?        ? 
1 1 1   32    7   13 o 24.85746 2.480056   35.47868   209.9   6.676016 1.232958          ?        ? 
1 1 1   32    8    0 o 5.419858 3.813534       0.08   180.0  -1.353247 1.503607  -1.353247 1.503607 
1 1 1   32    8    1 o 6.641177 3.106546   8.818017    33.4 -0.9322364 1.022453          ?        ? 
1 1 1   32    8    2 o 13.29054 3.921042   20.64875   330.6   1.894545 1.112669          ?        ? 
1 1 1   32    8    3 o 42.50278 1.415067   67.59503    50.6   18.19365 1.202886          ?        ? 
1 1 1   32    8    4 o 30.84674 1.754800   42.99610    28.0   9.623086 1.082597          ?        ? 
1 1 1   32    8    5 o 20.08761 2.694689   40.86442   301.4   4.149956 1.082597          ?        ? 
1 1 1   32    8    6 o 20.57240 2.777366   28.61338   175.6   4.390533 1.142741          ?        ? 
1 1 1   32    8    7 o 5.793890 2.801698   6.571635   269.6  -1.503607 0.9923807          ?        ? 
1 1 1   32    8    8 o 8.616184 3.229813   12.32449   107.0  0.6315150 0.7518036          ?        ? 
1 1 1   32    8    9 o 8.207219 3.560722   14.37788    28.4   0.000000 1.082597          ?        ? 
1 1 1   32    8   10 o 9.571096 3.833185   7.885948   215.5  0.6615872 1.112669          ?        ? 
1 1 1   32    8   11 o 9.068198 3.723794   16.77120   161.7  0.5112265 1.082597          ?        ? 
1 1 1   32    8   12 f 9.162487 3.637033   8.792917   114.6  0.7217315 0.9923807          ?        ? 
1 1 1   32    9    0 o 9.163942 5.287954   8.505404   360.0   1.172814 1.533679   1.172814 1.533679 
1 1 1   32    9    1 o 19.51684 2.773495   38.74520    68.4   3.909379 1.082597          ?        ? 
1 1 1   32    9    2 o 22.85749 2.302364   50.94750   302.8   5.322770 1.052525          ?        ? 
1 1 1   32    9    3 o 35.76563 1.723663   59.12252    48.1   12.93102 1.232958          ?        ? 
1 1 1   32    9    4 o 30.71600 1.909125   41.86678   111.4   9.562942 1.172814          ?        ? 
1 1 1   32    9    5 o 10.24861 3.825556   12.95082   273.4  0.9021643 1.052525          ?        ? 
1 1 1   32    9    6 o 22.26520 2.228547   18.88775   222.2   5.082192 0.9923807          ?        ? 
1 1 1   32    9    7 o 12.91148 3.880733   26.39347   202.2   1.834401 1.082597          ?        ? 
1 1 1   32    9    8 o 14.48482 2.695776   15.97478   329.3   2.255411 0.7518036          ?        ? 
1 1 1   32    9    9 o 7.535961 3.397902   8.671092   159.9 -0.3909379 1.082597          ?        ? 
1 1 1   32    9   10 o 10.08632 3.930497   8.997855    86.1  0.8720922 1.142741          ?        ? 
1 1 1   32    9   11 o 24.46123 2.335822   37.04252    14.9   6.285078 1.142741          ?        ? 
1 1 1   32    9   12 o 9.649261 3.726558   13.41054   328.0  0.9021643 1.022453          ?        ? 
1 1 1   32   10    0 o 8.601448 5.025602   12.34635   360.0  0.9923807 1.413391  0.9923807 1.413391 
1 1 1   32   10    1 o 11.38870 3.867750   20.17041   135.4   1.293102 1.052525          ?        ? 
1 1 1   32   10    2 o 20.37148 2.435712   44.70012    17.3   4.240172 0.9923807          ?        ? 
1 1 1   32   10    3 o 10.12872 3.854935   24.08587   309.4  0.8119479 1.082597          ?        ? 
1 1 1   32   10    4 o 11.77294 3.811020   20.23648   305.2   1.443463 1.022453          ?        ? 
1 1 1   32   10    5 o 11.34372 3.812092   14.36335   158.8   1.323174 1.022453          ?        ? 
1 1 1   32   10    6 o 22.90074 2.494989   36.56414   124.2   5.412986 1.142741          ?        ? 
1 1 1   32   10    7 o 25.57104 1.705234   27.66540   242.7   6.645944 0.8720922          ?        ? 
1 1 1   32   10    8 o 8.823265 3.184769   16.99569   219.5  0.7217315 0.7217315          ?        ? 
1 1 1   32   10    9 o 12.97864 4.126894   22.98131   198.3   1.894545 1.202886          ?        ? 
1 1 1   32   10   10 o 11.50742 4.021718   23.75322   319.8   1.443463 1.142741          ?        ? 
1 1 1   32   10   11 o 7.674326 3.453369   19.05893   263.1 -0.2706493 1.112669          ?        ? 
1 1 1   32   10   12 o 7.746723 3.470771   5.883746   137.4 -0.1503607 1.112669          ?        ? 
1 1 1   32   11    0 o 38.94184 2.137169   60.66725    -0.0   15.42701 1.653968   15.42701 1.653968 
1 1 1   32   11    1 o 48.60648 1.361109   77.03001   289.9   23.78707 1.323174          ?        ? 
1 1 1   32   11    2 o 41.17469 1.424193   64.31486   213.9   17.08098 1.172814          ?        ? 
1 1 1   32   11    3 o 17.41358 2.849445   38.99385   104.8   3.127503 0.9923807          ?        ? 
1 1 1   32   11    4 o 12.48850 3.774980   18.18029   110.9   1.684040 1.022453          ?        ? 
1 1 1   32   11    5 o 43.54746 1.415649   74.64112    46.2   19.15596 1.232958          ?        ? 
1 1 1   32   11    6 o 14.98235 3.724587   23.95268   118.4   2.495988 1.112669          ?        ? 
1 1 1   32   11    7 o 13.29370 3.292949   23.18549    11.4   1.954689 0.8720922          ?        ? 
1 1 1   32   11    8 o 12.14319 3.181336   20.07968   112.9   1.623896 0.7818757          ?        ? 
1 1 1   32   11    9 o 11.96296 4.030100   15.79957   309.3   1.563751 1.142741          ?        ? 
1 1 1   32   11   10 o 24.64468 2.501469   36.72132   222.5   6.405366 1.232958          ?        ? 
1 1 1   32   11   11 o 7.821739 3.510548   15.95532    59.0 -0.2105050 1.142741          ?        ? 
1 1 1   32   11   12 o 9.502205 3.790282   17.89685    55.1  0.8119479 1.082597          ?        ? 
1 1 1   32   12    0 o 9.379107 5.168261   3.762310   360.0   1.323174 1.383319   1.323174 1.383319 
1 1 1   32   12    1 o 33.10589 1.816725   53.43362   104.5   11.09662 1.202886          ?        ? 
1 1 1   32   12    2 o 29.31295 1.949210   57.41814   314.7   8.720922 1.142741          ?        ? 
1 1 1   32   12    3 o 20.46087 2.498556   35.42129   322.2   4.300317 1.022453          ?        ? 
1 1 1   32   12    4 o 13.23245 3.558366   22.33429    86.2   1.924617 0.9623086          ?        ? 
1 1 1   32   12    5 o 18.12483 2.903544   23.50144   112.9   3.428224 1.052525          ?        ? 
1 1 1   32   12    6 o 18.75836 2.484856   26.88254    32.5   3.638730 0.9322364          ?        ? 
1 1 1   32   12    7 o 10.70952 3.580834   26.97381     6.1   1.202886 0.9021643          ?        ? 
1 1 1   32   12    8 o 21.13020 1.921297   35.64795     8.3   4.570966 0.8119479          ?        ? 
1 1 1   32   12    9 o 8.941175 3.812860   14.53667   175.9  0.2405772 1.202886          ?        ? 
1 1 1   32   12   10 o 8.920705 3.756226   14.05125   192.4  0.3608657 1.142741          ?        ? 
1 1 1   32   12   11 o 17.95566 3.389665   26.59279     3.5   3.728946 1.172814          ?        ? 
1 1 1   32   12   12 o 18.48425 3.379469   33.27157   350.9   3.999595 1.202886          ?        ? 
1 1 1   32   13    0 o 10.91411 5.413861   22.65298   360.0   1.864473 1.413391   1.864473 1.413391 
1 1 1   32   13    1 o 15.09182 3.279905   26.54501   115.3   2.465916 0.9623086          ?        ? 
1 1 1   32   13    2 o 10.34696 3.734500   23.40749   254.3  0.9923807 0.9923807          ?        ? 
1 1 1   32   13    3 o 15.15736 3.533801   37.20988   340.2   2.526060 1.052525          ?        ? 
1 1 1   32   13    4 o 18.90028 2.625306   34.64846   357.7   3.698874 0.9923807          ?        ? 
1 1 1   32   13    5 o 8.099553 3.486415   4.637238    65.0       0.03 1.022453          ?        ? 
1 1 1   32   13    6 o 18.34108 2.459409   14.58921   235.8   3.488369 0.9021643          ?        ? 
1 1 1   32   13    7 o 5.423684 2.623326   3.852434   280.9  -1.323174 0.8720922          ?        ? 
1 1 1   32   13    8 o 16.98845 2.478214   26.67979   140.2   3.007215 0.8420200          ?        ? 
1 1 1   32   13    9 o 7.886508 3.583773   13.96216   211.3 -0.4510822 1.232958          ?        ? 
1 1 1   32   13   10 o 14.31614 3.963713   23.26558   260.7   2.435844 1.172814          ?        ? 
1 1 1   32   13   11 o 8.801888 3.809062   13.76050   274.1  0.2706493 1.232958          ?        ? 
1 1 1   32   14    0 o 6.969176 4.499320   8.310409     0.0  0.1804329 1.413391  0.1804329 1.413391 
1 1 1   32   14    1 o 14.84862 3.323881   20.39583   239.1   2.405771 0.9623086          ?        ? 
1 1 1   32   14    2 o 17.84522 2.780523   27.84764   203.2   3.307936 0.9923807          ?        ? 
1 1 1   32   14    3 f 35.08833 1.628378   54.80289   275.2   12.47994 1.142741          ?        ? 
1 1 1   32   14    4 o 16.13007 3.455845   29.53729    56.6   2.856854 1.082597          ?        ? 
1 1 1   32   14    5 o 20.57921 2.264996   28.59010    54.8   4.360461 0.9322364          ?        ? 
1 1 1   32   14    6 o 10.80764 3.580835   26.51012    52.4   1.232958 0.9021643          ?        ? 
1 1 1   32   14    7 o 5.823164 2.745484   14.71952    22.7 -0.8720922 0.8420200          ?        ? 
1 1 1   32   14    8 o 10.65003 3.391011   23.40323   159.6   1.232958 0.8119479          ?        ? 
1 1 1   32   14    9 o 9.123374 3.874448   11.95100   271.9  0.3307936 1.232958          ?        ? 
1 1 1   32   14   10 o 9.397295 3.926347   22.75091    42.6  0.5412986 1.232958          ?        ? 
1 1 1   32   14   11 o 13.66501 4.326610   26.17512     1.2   2.375700 1.323174          ?        ? 
1 1 1   32   15    0 o 7.929922 4.833977   15.35209     0.0  0.7217315 1.413391  0.7217315 1.413391 
1 1 1   32   15    1 o 12.81081 3.678727   20.29187    86.5   1.804329 0.9923807          ?        ? 
1 1 1   32   15    2 o 7.508164 3.346413   11.96860   175.0 -0.3007214 1.022453          ?        ? 
1 1 1   32   15    3 o 9.562325 3.719607   22.02796   294.1  0.6916593 1.022453          ?        ? 
1 1 1   32   15    4 o 27.88095 1.941464   49.94766   309.9   7.939046 1.082597          ?        ? 
1 1 1   32   15    5 o 18.14326 2.569099   24.50235   126.5   3.428224 0.9322364          ?        ? 
1 1 1   32   15    6 o 10.65956 3.640030   18.99313   241.1   1.172814 0.9322364          ?        ? 
1 1 1   32   15    7 o 12.59662 3.471515   15.27012    55.8   1.774257 0.9021643          ?        ? 
1 1 1   32   15    8 o 12.51519 3.397375   15.48991   186.5   1.774257 0.8720922          ?        ? 
1 1 1   32   15    9 o 9.642786 4.099724   3.478210    14.7  0.4210100 1.383319          ?        ? 
1 1 1   32   15   10 o 12.39343 4.236904   7.060646   240.1   1.864473 1.263030          ?        ? 
1 1 1   32   15   11 o 8.248988 3.675744   9.404057   143.5      -0.03 1.232958          ?        ? 
1 1 1   32   16    0 o 28.43222 2.468179   37.34767     0.0   8.390128 1.383319   8.390128 1.383319 
1 1 1   32   16    1 o 12.81321 3.445258   13.11543   107.6   1.804329 0.9021643          ?        ? 
1 1 1   32   16    2 o 8.520447 3.568711   16.68517   129.5  0.2405772 1.022453          ?        ? 
1 1 1   32   16    3 o 10.86564 3.752540   18.07504    68.7   1.202886 0.9923807          ?        ? 
1 1 1   32   16    4 o 7.678890 3.259657   20.12396   330.1  0.1202886 0.8720922          ?        ? 
1 1 1   32   16    5 o 25.12596 1.974811   30.19214    99.1   6.465511 0.9923807          ?        ? 
1 1 1   32   16    6 o 8.151911 3.410581   9.397607   252.1  0.2405772 0.9322364          ?        ? 
1 1 1   32   16    7 o 12.65090 3.464939   31.95001    52.6   1.804329 0.9021643          ?        ? 
1 1 1   32   16    8 o 18.52342 2.435199   30.94128    96.0   3.608657 0.9021643          ?        ? 
1 1 1   32   16    9 f 14.71507 4.255105   32.73637    52.3   2.646349 1.323174          ?        ? 
1 1 1   32   16   10 o 8.081870 3.671908   9.287833   353.6 -0.3007214 1.293102          ?        ? 
1 1 1   32   17    0 o 19.33021 4.064468   16.97967   180.0   4.330389 1.383319   4.330389 1.383319 
1 1 1   32   17    1 o 6.990653 3.173858   13.04636    61.0 -0.4510822 0.9623086          ?        ? 
1 1 1   32   17    2 o 13.12085 3.866648   29.06458   310.7   1.924617 1.082597          ?        ? 
1 1 1   32   17    3 o 14.90532 3.402528   27.62561   332.6   2.465916 0.9923807          ?        ? 
1 1 1   32   17    4 o 8.411807 3.417572   12.27497   106.6  0.3909379 0.9021643          ?        ? 
1 1 1   32   17    5 o 12.10760 3.517567   16.32268   343.3   1.623896 0.9021643          ?        ? 
1 1 1   32   17    6 o 10.87751 3.640026   7.593006   187.8   1.263030 0.9322364          ?        ? 
1 1 1   32   17    7 o 20.14391 2.313942   39.60019    65.9   4.240172 0.9322364          ?        ? 
1 1 1   32   17    8 o 20.18008 2.309793   25.68251     7.2   4.270245 0.9322364          ?        ? 
1 1 1   32   17    9 f 11.25361 4.268003   13.21435   125.5   1.383319 1.323174          ?        ? 
1 1 1   32   17   10 o 7.698156 3.559178   21.12539    49.8 -0.5713707 1.293102          ?        ? 
1 1 1   32   18    0 o 11.70639 5.758499   1.922998   180.0   2.225339 1.593824   2.225339 1.593824 
1 1 1   32   18    1 o 19.78861 2.659422   33.71210   138.5   4.089812 1.052525          ?        ? 
1 1 1   32   18    2 o 5.637720 2.752582   2.833976   100.1  -1.774257 1.022453          ?        ? 
1 1 1   32   18    3 f 7.665713 3.367127   7.719349   317.8 -0.1202886 0.9923807          ?        ? 
1 1 1   32   18    4 o 21.68409 2.149586   21.16157   345.1   4.841615 0.9322364          ?        ? 
1 1 1   32   18    5 o 14.11569 3.348360   29.92154   255.4   2.225339 0.9322364          ?        ? 
1 1 1   32   18    6 o 8.770209 3.472042   15.56377   185.7  0.5713707 0.9021643          ?        ? 
1 1 1   32   18    7 o 6.592869 3.017556   4.171663   102.3 -0.4811543 0.9021643          ?        ? 
1 1 1   32   18    8 o 25.16943 1.851922   30.11368   234.0   6.555727 0.9322364          ?        ? 
1 1 1   32   18    9 o 10.91751 3.580838   22.50290   224.6   1.383319 0.9021643          ?        ? 
1 1 1   32   19    0 o 6.233521 4.169414   11.60248     0.0 -0.2405772 1.383319 -0.2405772 1.383319 
1 1 1   32   19    1 f 7.670410 3.389573   8.762420   104.2 -0.1804329 1.022453          ?        ? 
1 1 1   32   19    2 o 10.28125 3.628587   16.32511   157.7   1.052525 0.9322364          ?        ? 
1 1 1   32   19    3 o 7.704927 3.322937   13.16487   265.4       0.03 0.9322364          ?        ? 
1 1 1   32   19    4 o 21.81307 2.274739   29.58544   126.1   4.931832 0.9923807          ?        ? 
1 1 1   32   19    5 o 8.019699 3.323307   16.67801   221.4  0.3007214 0.8720922          ?        ? 
1 1 1   32   19    6 o 9.194246 3.601945   13.41252    11.0  0.6916593 0.9623086          ?        ? 
1 1 1   32   19    7 o 21.70986 2.216294   31.93324   232.1   4.931832 0.9623086          ?        ? 
1 1 1   32   19    8 o 22.81764 1.976901   37.71191   114.7   5.443058 0.9021643          ?        ? 
1 1 1   32   19    9 o 10.87679 3.379575   18.00663   264.1   1.383319 0.8119479          ?        ? 
1 1 1   32   20    0 o 41.81740 1.987199   67.97118   180.0   17.83278 1.653968   17.83278 1.653968 
1 1 1   32   20    1 o 12.97204 3.809315   22.68923   274.7   1.894545 1.052525          ?        ? 
1 1 1   32   20    2 o 7.961307 3.344170   23.56737   162.1  0.2105050 0.9021643          ?        ? 
1 1 1   32   20    3 o 15.05188 3.287395   20.54744    47.6   2.526060 0.9623086          ?        ? 
1 1 1   32   20    4 o 26.99820 1.837864   42.51290   163.2   7.487964 0.9923807          ?        ? 
1 1 1   32   20    5 o 7.259961 3.286248   5.334595   188.8 -0.3608657 1.022453          ?        ? 
1 1 1   32   20    6 o 6.266885 2.938416   17.05052    33.1 -0.7818757 0.9322364          ?        ? 
1 1 1   32   20    7 o 8.842074 3.520289   14.49597   307.2  0.6315150 0.9322364          ?        ? 
1 1 1   32   20    8 o 7.310130 3.210688   8.138678    71.6   0.000000 0.9021643          ?        ? 
1 1 1   32   21    0 o 8.428911 5.182752   8.294841   180.0  0.8720922 1.653968  0.8720922 1.653968 
1 1 1   32   21    1 o 7.903884 3.363136   16.48072   328.9  0.1503607 0.9322364          ?        ? 
1 1 1   32   21    2 o 18.17683 2.647075   25.25187   160.8   3.488369 0.9623086          ?        ? 
1 1 1   32   21    3 f 18.12532 2.903466   15.26214   137.8   3.518441 1.052525          ?        ? 
1 1 1   32   21    4 o 13.51084 3.604660   32.26915   127.8   2.105050 0.9923807          ?        ? 
1 1 1   32   21    5 o 15.96912 3.312385   27.82555   291.3   2.886926 1.022453          ?        ? 
1 1 1   32   21    6 o 6.654590 3.054837   6.313392    53.7 -0.4811543 0.9322364          ?        ? 
1 1 1   32   21    7 o 9.293049 3.653341   13.12543   114.8  0.7818757 0.9923807          ?        ? 
1 1 1   32   21    8 o 12.40764 3.410410   16.65956    74.4   1.834401 0.8720922          ?        ? 
1 1 1   32   22    0 o 36.14299 1.840599   35.29941    -0.0   13.35203 1.323174   13.35203 1.323174 
1 1 1   32   22    1 o 8.531346 3.570725   6.101987   256.4  0.3307936 1.022453          ?        ? 
1 1 1   32   22    2 o 11.69528 3.922609   12.38095   264.8   1.533679 1.082597          ?        ? 
1 1 1   32   22    3 o 8.578842 3.579366   8.880146    32.7  0.3608657 1.022453          ?        ? 
1 1 1   32   22    4 o 6.956225 3.162383   17.93987   190.1 -0.3909379 0.9623086          ?        ? 
1 1 1   32   22    5 o 15.03467 3.382322   24.20811   225.8   2.616277 0.9923807          ?        ? 
1 1 1   32   22    6 o 9.626844 3.552017   12.06102   131.7  0.9623086 0.9021643          ?        ? 
1 1 1   32   22    7 o 8.016345 3.414148   9.628870   151.5  0.2706493 0.9623086          ?        ? 
1 1 1   32   23    0 o 7.295041 4.642338   13.82212   180.0  0.4510822 1.443463  0.4510822 1.443463 
1 1 1   32   23    1 o 18.83381 2.554737   26.48295     5.8   3.759018 0.9623086          ?        ? 
1 1 1   32   23    2 o 12.17316 3.919615   10.38574   315.3   1.714112 1.082597          ?        ? 
1 1 1   32   23    3 o 12.59828 3.768330   22.20604   338.2   1.864473 1.022453          ?        ? 
1 1 1   32   23    4 o 26.35941 2.053531   40.64507   193.2   7.277459 1.082597          ?        ? 
1 1 1   32   23    5 o 11.87716 3.745482   13.03024   333.9   1.684040 0.9923807          ?        ? 
1 1 1   32   23    6 o 25.81938 1.921775   42.74102   239.1   6.976738 0.9923807          ?        ? 
1 1 1   32   24    0 o 10.19352 5.493770   11.28212   180.0   1.804329 1.533679   1.804329 1.533679 
1 1 1   32   24    1 o 25.52114 2.003149   35.90534    66.4   6.796305 1.022453          ?        ? 
1 1 1   32   24    2 o 7.958573 3.481879   15.20724    85.9       0.06 1.052525          ?        ? 
1 1 1   32   24    3 o 31.71751 1.706624   41.32806   153.0   10.40496 1.082597          ?        ? 
1 1 1   32   24    4 o 12.81449 3.751774   9.439378    29.7   1.984761 1.022453          ?        ? 
1 1 1   32   24    5 o 18.59168 2.749760   18.62157   207.7   3.789090 1.022453          ?        ? 
1 1 1   32   25    0 o 25.26274 2.923520   32.89204    -0.0   6.946666 1.443463   6.946666 1.443463 
1 1 1   32   25    1 o 11.87260 3.745710   21.43723   223.7   1.684040 0.9923807          ?        ? 
1 1 1   32   25    2 o 20.38389 2.655521   25.92644   154.9   4.510822 1.082597          ?        ? 
1 1 1   32   25    3 o 5.053899 2.526941   6.341929   124.7  -2.706493 1.082597          ?        ? 
1 1 1   32   25    4 o 10.72863 3.848597   10.83147   237.6   1.323174 1.052525          ?        ? 
1 1 1   32   26    0 o 8.693027 5.164511   12.02181    -0.0   1.232958 1.533679   1.232958 1.533679 
1 1 1   32   26    1 o 17.05012 3.114020   17.47607   141.5   3.338008 1.022453          ?        ? 
1 1 1   32   26    2 x        ?      ?   12.41952   101.9          ?        ?          ?        ? 
1 1 1   33    0    1 o 5.661404 3.865506   14.10856   270.0 -0.5713707 1.293102 -0.5713707 1.293102 
1 1 1   33    0    2 o 5.443279 3.758780   14.77156    90.0 -0.7518036 1.293102 -0.7518036 1.293102 
1 1 1   33    0    3 o 21.05301 4.469228   59.76524    90.0   5.112265 1.653968   5.112265 1.653968 
1 1 1   33    0    4 o 12.93893 6.063136   45.38778    90.0   2.616277 1.744184   2.616277 1.744184 
1 1 1   33    0    5 o 6.867846 4.456761   23.58493    90.0  0.1202886 1.413391  0.1202886 1.413391 
1 1 1   33    0    6 o 19.21673 4.798757   43.10627    90.0   4.480750 1.593824   4.480750 1.593824 
1 1 1   33    0    7 o 10.07555 5.398069   19.95832    90.0   1.623896 1.473535   1.623896 1.473535 
1 1 1   33    0    8 o 13.45232 5.128542   22.51198    90.0   2.586205 1.293102   2.586205 1.293102 
1 1 1   33    0    9 o 7.069621 4.355701   1.391696   270.0  0.5412986 1.172814  0.5412986 1.172814 
1 1 1   33    0   10 o 6.144874 3.995527   20.43135    90.0  0.1202886 1.142741  0.1202886 1.142741 
1 1 1   33    0   11 o 15.73349 8.181969   28.81883    90.0   5.022048 3.307936   5.022048 3.307936 
1 1 1   33    0   12 o 7.939701 5.171689   3.964922    90.0  0.5112265 1.924617  0.5112265 1.924617 
1 1 1   33    1    0 o 6.908961 4.395339   22.59048   180.0  0.2706493 1.293102  0.2706493 1.293102 
1 1 1   33    1    1 o 27.13336 1.884125   43.18447   202.3   7.457891 1.022453          ?        ? 
1 1 1   33    1    2 o 8.775309 3.577961   11.40928   242.6  0.3608657 0.9923807          ?        ? 
1 1 1   33    1    3 o 13.33286 3.846769   19.51394   131.9   1.924617 1.082597          ?        ? 
1 1 1   33    1    4 o 22.35263 2.354365   30.51413    99.4   5.112265 1.052525          ?        ? 
1 1 1   33    1    5 o 7.398225 3.390333   11.98956   310.2 -0.6916593 1.142741          ?        ? 
1 1 1   33    1    6 o 27.54085 1.910843   55.08572   342.4   7.728541 1.052525          ?        ? 
1 1 1   33    1    7 o 7.461533 3.312895   11.08944   191.0 -0.2405772 0.9923807          ?        ? 
1 1 1   33    1    8 o 12.02842 3.976717   16.28741   172.6   1.563751 1.112669          ?        ? 
1 1 1   33    1    9 o 11.15515 3.576730   27.14093    41.8   1.353247 0.9021643          ?        ? 
1 1 1   33    1   10 o 12.40726 2.948118   17.09777    29.7   1.714112 0.7217315          ?        ? 
1 1 1   33    1   11 o 14.38457 4.804193   23.81169    62.0   2.616277 1.623896          ?        ? 
1 1 1   33    1   12 o 13.70197 5.128964   24.97486   181.4   2.495988 1.894545          ?        ? 
1 1 1   33    2    0 o 5.615709 3.881117   14.43828   180.0 -0.8119479 1.383319 -0.8119479 1.383319 
1 1 1   33    2    1 o 11.70374 3.812092   19.59345   222.4   1.413391 1.022453          ?        ? 
1 1 1   33    2    2 o 29.26497 1.746889   57.55850   328.2   8.660777 1.022453          ?        ? 
1 1 1   33    2    3 o 23.65639 2.033930   43.49585    31.3   5.683635 0.9623086          ?        ? 
1 1 1   33    2    4 o 15.58016 3.198163   31.73145   308.7   2.616277 0.9623086          ?        ? 
1 1 1   33    2    5 o 9.653451 3.726893   14.78040   251.5  0.7217315 1.022453          ?        ? 
1 1 1   33    2    6 o 8.989624 3.643621   10.81092   252.8  0.4510822 1.022453          ?        ? 
1 1 1   33    2    7 o 15.91195 3.406108   38.93053    74.3   2.796710 1.052525          ?        ? 
1 1 1   33    2    8 o 16.71708 3.083962   32.90948   339.3   3.037287 0.9923807          ?        ? 
1 1 1   33    2    9 o 8.265329 3.431212   10.23835     1.2  0.3007214 0.9322364          ?        ? 
1 1 1   33    2   10 o 8.856567 3.624857   1.600069   137.6  0.4811543 1.022453          ?        ? 
1 1 1   33    2   11 o 12.01892 3.196394   23.68162     4.9   1.653968 0.7818757          ?        ? 
1 1 1   33    2   12 o 17.09274 5.132973   19.76163   213.0   4.059740 1.894545          ?        ? 
1 1 1   33    3    0 o 11.19979 5.278425   16.96407     0.0   1.924617 1.323174   1.924617 1.323174 
1 1 1   33    3    1 o 22.75403 2.114589   37.11238    51.6   5.262625 0.9623086          ?        ? 
1 1 1   33    3    2 o 10.46851 3.789447   24.86581    48.8  0.9923807 1.022453          ?        ? 
1 1 1   33    3    3 o 8.881481 3.561546   30.56952    19.4  0.4510822 0.9623086          ?        ? 
1 1 1   33    3    4 f 12.08824 3.732290   26.20029   112.2   1.563751 0.9923807          ?        ? 
1 1 1   33    3    5 o 10.57448 3.892253   20.77753    34.3   1.022453 1.082597          ?        ? 
1 1 1   33    3    6 o 11.64688 3.922611   14.19521   223.9   1.413391 1.082597          ?        ? 
1 1 1   33    3    7 o 8.774599 3.701149   7.468508   305.6  0.2405772 1.112669          ?        ? 
1 1 1   33    3    8 o 20.63605 2.477346   37.45272   259.9   4.420605 1.022453          ?        ? 
1 1 1   33    3    9 f 8.892726 3.440149   7.813678   239.3  0.6315150 0.8720922          ?        ? 
1 1 1   33    3   10 o 12.50588 3.905746   21.08821   246.7   1.804329 1.082597          ?        ? 
1 1 1   33    3   11 o 10.18686 3.625215   18.08461   150.8   1.112669 0.9322364          ?        ? 
1 1 1   33    3   12 o 13.90313 4.001420   29.79502    74.8   2.405771 1.172814          ?        ? 
1 1 1   33    4    0 o 4.536740 3.272575   11.01790   360.0  -1.864473 1.323174  -1.864473 1.323174 
1 1 1   33    4    1 o 31.96611 1.599276   66.13337    43.3   10.31474 1.022453          ?        ? 
1 1 1   33    4    2 o 10.35993 3.631333   35.51455   103.5   1.022453 0.9322364          ?        ? 
1 1 1   33    4    3 o 7.750689 3.449281   10.82902    42.6 -0.3307936 1.082597          ?        ? 
1 1 1   33    4    4 o 10.83244 3.949950   19.83323    58.6   1.082597 1.112669          ?        ? 
1 1 1   33    4    5 o 8.814855 3.736064   20.77425   201.8  0.1804329 1.142741          ?        ? 
1 1 1   33    4    6 o 20.92463 2.658755   32.89700   320.6   4.540894 1.112669          ?        ? 
1 1 1   33    4    7 o 15.83583 3.333205   27.43995   175.1   2.766637 1.022453          ?        ? 
1 1 1   33    4    8 o 7.461039 3.335325   5.822520    93.2 -0.3007214 1.022453          ?        ? 
1 1 1   33    4    9 f 7.085164 3.049268   14.24344   108.1       0.03 0.7818757          ?        ? 
1 1 1   33    4   10 f 11.94910 3.866521   14.73672   191.3   1.623896 1.052525          ?        ? 
1 1 1   33    4   11 o 9.904872 3.615154   6.285797   175.8   1.022453 0.9322364          ?        ? 
1 1 1   33    4   12 o 11.10401 3.911161   13.72569    66.7   1.443463 1.082597          ?        ? 
1 1 1   33    5    0 o 12.58450 5.402847   19.90801   180.0   2.345627 1.383319   2.345627 1.383319 
1 1 1   33    5    1 o 28.80788 1.983383   44.38224   276.1   8.420200 1.142741          ?        ? 
1 1 1   33    5    2 o 21.06119 2.498731   47.32414    54.0   4.540894 1.052525          ?        ? 
1 1 1   33    5    3 f 20.40968 2.799508   32.76680   244.6   4.300317 1.142741          ?        ? 
1 1 1   33    5    4 o 10.21428 3.823011   22.71568   105.5  0.9021643 1.052525          ?        ? 
1 1 1   33    5    5 o 9.268950 3.785473   16.57247    76.1  0.4510822 1.112669          ?        ? 
1 1 1   33    5    6 o 14.31128 3.816270   31.51294    75.5   2.285483 1.112669          ?        ? 
1 1 1   33    5    7 o 30.80425 1.659597   54.40991    42.4   9.653158 1.022453          ?        ? 
1 1 1   33    5    8 o 15.63584 3.365931   24.01545   112.1   2.706493 1.022453          ?        ? 
1 1 1   33    5    9 o 18.93155 2.065007   26.92194    81.5   3.698874 0.7818757          ?        ? 
1 1 1   33    5   10 o 18.74454 2.807551   23.37564   170.7   3.759018 1.052525          ?        ? 
1 1 1   33    5   11 o 8.682217 3.421105   11.97281   287.1  0.6315150 0.8720922          ?        ? 
1 1 1   33    5   12 o 6.583342 2.997564   9.081071   358.5 -0.3307936 0.8720922          ?        ? 
1 1 1   33    6    0 f 8.604062 5.084623   22.36822   180.0  0.9623086 1.473535  0.9623086 1.473535 
1 1 1   33    6    1 o 25.08240 2.457815   37.93937   248.2   6.435439 1.232958          ?        ? 
1 1 1   33    6    2 o 11.23178 3.915497   22.29221   232.8   1.232958 1.082597          ?        ? 
1 1 1   33    6    3 o 15.25017 3.684006   26.25156   100.0   2.556132 1.112669          ?        ? 
1 1 1   33    6    4 o 10.88024 3.951655   27.12052   300.7   1.112669 1.112669          ?        ? 
1 1 1   33    6    5 o 18.51235 2.923986   26.88761   328.1   3.578585 1.082597          ?        ? 
1 1 1   33    6    6 o 8.384829 3.542879   9.252346   206.0  0.1804329 1.022453          ?        ? 
1 1 1   33    6    7 o 8.664766 3.594994   12.64015    89.6  0.3307936 1.022453          ?        ? 
1 1 1   33    6    8 o 18.97357 2.615166   26.71671   149.9   3.759018 0.9923807          ?        ? 
1 1 1   33    6    9 f 16.13537 3.709624   21.56029   208.4   2.977142 1.172814          ?        ? 
1 1 1   33    6   10 o 7.529165 3.416877   15.36012   280.7 -0.3909379 1.112669          ?        ? 
1 1 1   33    6   11 o 14.96679 3.392928   30.94398   300.7   2.616277 0.9923807          ?        ? 
1 1 1   33    6   12 o 6.597202 3.018711   4.753671   334.2 -0.3909379 0.9021643          ?        ? 
1 1 1   33    7    0 o 22.07625 4.068694   41.62466   360.0   5.443058 1.623896   5.443058 1.623896 
1 1 1   33    7    1 o 9.615451 3.840331   7.487199     9.1  0.5713707 1.112669          ?        ? 
1 1 1   33    7    2 o 31.19648 1.976117   53.14849   305.9   9.893736 1.232958          ?        ? 
1 1 1   33    7    3 o 7.970644 3.508858   12.81995   116.4 -0.1804329 1.082597          ?        ? 
1 1 1   33    7    4 o 24.93560 2.231086   40.76098   193.9   6.375295 1.112669          ?        ? 
1 1 1   33    7    5 o 29.54914 1.933629   42.86628   181.4   8.901355 1.142741          ?        ? 
1 1 1   33    7    6 o 15.42186 3.576428   15.01938   314.7   2.646349 1.082597          ?        ? 
1 1 1   33    7    7 o 7.831967 3.429092   12.23858   120.1      -0.09 1.022453          ?        ? 
1 1 1   33    7    8 o 7.294498 3.207212   1.918388     8.4 -0.1202886 0.9021643          ?        ? 
1 1 1   33    7    9 o 25.61155 2.230910   40.16586   205.5   6.826377 1.142741          ?        ? 
1 1 1   33    7   10 o 16.94067 3.492126   27.01701   233.6   3.277864 1.142741          ?        ? 
1 1 1   33    7   11 o 6.845854 3.146498   14.45004   341.8 -0.4811543 0.9923807          ?        ? 
1 1 1   33    8    0 o 8.468230 5.101969   10.95339     0.0  0.8720922 1.533679  0.8720922 1.533679 
1 1 1   33    8    1 o 11.67419 3.976722   26.30994   285.1   1.383319 1.112669          ?        ? 
1 1 1   33    8    2 o 23.64917 2.416029   39.94309   341.6   5.743780 1.142741          ?        ? 
1 1 1   33    8    3 o 13.59853 3.822397   15.82495   219.3   2.044906 1.082597          ?        ? 
1 1 1   33    8    4 o 12.34618 3.850165   21.19178   350.4   1.653968 1.052525          ?        ? 
1 1 1   33    8    5 o 31.89495 1.932842   67.17627   219.3   10.37489 1.232958          ?        ? 
1 1 1   33    8    6 f 6.520763 3.108615   14.82684    64.8  -1.263030 1.112669          ?        ? 
1 1 1   33    8    7 o 7.778944 3.417308   10.44393    11.8 -0.1202886 1.022453          ?        ? 
1 1 1   33    8    8 o 22.01772 1.843851   33.47291    79.1   4.961904 0.8119479          ?        ? 
1 1 1   33    8    9 o 14.47753 3.796125   9.183796   102.6   2.435844 1.112669          ?        ? 
1 1 1   33    8   10 o 7.004725 3.262636   15.78635     2.6 -0.7518036 1.112669          ?        ? 
1 1 1   33    8   11 o 10.12202 3.772055   22.72952   311.2   1.082597 1.022453          ?        ? 
1 1 1   33    9    0 o 7.973296 4.970368   8.782718   180.0  0.6014429 1.563751  0.6014429 1.563751 
1 1 1   33    9    1 o 27.10400 2.219018   48.56204   284.8   7.518036 1.202886          ?        ? 
1 1 1   33    9    2 o 31.60609 1.712640   42.35733   181.9   10.13431 1.082597          ?        ? 
1 1 1   33    9    3 o 25.83846 2.094934   37.31164   187.6   6.826377 1.082597          ?        ? 
1 1 1   33    9    4 o 10.32709 3.874860   29.52372   113.7  0.9322364 1.082597          ?        ? 
1 1 1   33    9    5 o 22.99317 2.288777   22.08459    64.5   5.443058 1.052525          ?        ? 
1 1 1   33    9    6 o 15.16161 3.697424   14.21605   340.4   2.586205 1.112669          ?        ? 
1 1 1   33    9    7 o 15.92182 3.319775   25.08367   348.0   2.796710 1.022453          ?        ? 
1 1 1   33    9    8 o 8.643765 3.280068   24.17389   135.2  0.6315150 0.7818757          ?        ? 
1 1 1   33    9    9 o 17.28913 3.513976   32.17154   263.6   3.398152 1.172814          ?        ? 
1 1 1   33    9   10 o 15.01013 3.800855   33.39205   225.2   2.676421 1.142741          ?        ? 
1 1 1   33    9   11 o 11.13861 3.912385   6.929131   350.8   1.443463 1.082597          ?        ? 
1 1 1   33   10    0 o 42.46677 2.135880   70.77369   180.0   18.37408 1.804329   18.37408 1.804329 
1 1 1   33   10    1 o 33.05054 1.774273   55.18758   116.8   11.09662 1.172814          ?        ? 
1 1 1   33   10    2 o 38.09270 1.618365   60.56347    41.7   14.70528 1.232958          ?        ? 
1 1 1   33   10    3 o 10.04920 3.721877   13.34172   286.2  0.9021643 0.9923807          ?        ? 
1 1 1   33   10    4 o 9.211027 3.711842   11.57157    97.5  0.5112265 1.052525          ?        ? 
1 1 1   33   10    5 o 7.808046 3.485196   11.01413   175.8 -0.3007214 1.112669          ?        ? 
1 1 1   33   10    6 o 7.731682 3.424968   7.032008   277.8 -0.2105050 1.052525          ?        ? 
1 1 1   33   10    7 o 10.36397 3.520654   21.56369    91.9   1.112669 0.8720922          ?        ? 
1 1 1   33   10    8 f 23.56855 1.722524   27.56669   325.0   5.683635 0.8119479          ?        ? 
1 1 1   33   10    9 o 6.743298 3.185084   10.59712   238.0  -1.082597 1.142741          ?        ? 
1 1 1   33   10   10 o 13.77956 4.013011   22.00765   348.4   2.315555 1.172814          ?        ? 
1 1 1   33   10   11 o 13.08323 4.061059   13.34809     1.2   2.135122 1.172814          ?        ? 
1 1 1   33   11    0 o 7.308563 4.723353   21.82269   180.0  0.2105050 1.563751  0.2105050 1.563751 
1 1 1   33   11    1 o 7.956013 3.523269   23.49812   284.4 -0.2405772 1.112669          ?        ? 
1 1 1   33   11    2 o 17.71032 3.263715   39.56401   148.3   3.398152 1.112669          ?        ? 
1 1 1   33   11    3 o 7.331619 3.325631   10.61398   330.2 -0.4811543 1.052525          ?        ? 
1 1 1   33   11    4 o 24.52681 2.268272   37.44179   236.4   6.194862 1.112669          ?        ? 
1 1 1   33   11    5 o 21.06315 2.641269   36.65365   295.8   4.631110 1.112669          ?        ? 
1 1 1   33   11    6 o 25.53739 2.296268   34.00291   270.1   6.736160 1.172814          ?        ? 
1 1 1   33   11    7 o 25.00950 1.863764   37.55784   242.5   6.405366 0.9322364          ?        ? 
1 1 1   33   11    8 o 9.342505 3.320486   2.659273   244.8  0.8720922 0.7818757          ?        ? 
1 1 1   33   11    9 o 12.72636 4.134791   21.64177    77.6   1.894545 1.202886          ?        ? 
1 1 1   33   11   10 o 6.209945 3.012159   10.15610   241.4  -1.623896 1.172814          ?        ? 
1 1 1   33   11   11 o 17.17893 3.358244   20.55295   206.0   3.458297 1.112669          ?        ? 
1 1 1   33   12    0 o 16.06233 4.936248   5.888480    -0.0   3.338008 1.383319   3.338008 1.383319 
1 1 1   33   12    1 o 8.171915 3.473338   12.59080   332.0  0.1202886 0.9923807          ?        ? 
1 1 1   33   12    2 o 7.928533 3.424021   6.147242   128.8   0.000000 0.9923807          ?        ? 
1 1 1   33   12    3 o 28.18313 1.973999   48.14443   264.0   8.119479 1.112669          ?        ? 
1 1 1   33   12    4 f 8.262913 3.572448   11.96789   244.2       0.03 1.082597          ?        ? 
1 1 1   33   12    5 o 9.529168 3.826196   18.89124   217.7  0.6014429 1.112669          ?        ? 
1 1 1   33   12    6 o 10.32699 3.459415   20.79233    20.1   1.112669 0.8420200          ?        ? 
1 1 1   33   12    7 o 14.92887 3.122615   29.23757   223.3   2.465916 0.9021643          ?        ? 
1 1 1   33   12    8 o 11.43689 3.341690   7.235541   187.2   1.473535 0.8119479          ?        ? 
1 1 1   33   12    9 o 6.849738 3.232636   13.25836   188.1  -1.052525 1.172814          ?        ? 
1 1 1   33   12   10 o 11.53025 4.069894   11.21585   121.3   1.563751 1.172814          ?        ? 
1 1 1   33   13    0 o 24.92416 2.966157   39.33173     0.0   6.615872 1.443463   6.615872 1.443463 
1 1 1   33   13    1 o 12.49722 3.840722   12.54425   314.8   1.714112 1.052525          ?        ? 
1 1 1   33   13    2 o 10.67105 3.895706   12.20907   315.7   1.082597 1.082597          ?        ? 
1 1 1   33   13    3 o 20.11764 2.765407   31.64921    76.6   4.240172 1.112669          ?        ? 
1 1 1   33   13    4 o 21.60805 2.435493   38.96349   331.4   4.841615 1.052525          ?        ? 
1 1 1   33   13    5 o 8.532575 3.570949   19.66683   191.1  0.2706493 1.022453          ?        ? 
1 1 1   33   13    6 o 14.82636 3.233458   20.37412   157.8   2.435844 0.9322364          ?        ? 
1 1 1   33   13    7 o 22.41701 2.079306   33.73099   127.9   5.202481 0.9322364          ?        ? 
1 1 1   33   13    8 o 15.96163 2.637638   14.54825   238.6   2.706493 0.8420200          ?        ? 
1 1 1   33   13    9 o 8.730844 3.770105   5.790910   257.2  0.2405772 1.202886          ?        ? 
1 1 1   33   13   10 o 10.39626 4.036436   15.14994    78.0   1.112669 1.202886          ?        ? 
1 1 1   33   14    0 o 11.71535 5.459684   14.65570   180.0   2.165194 1.413391   2.165194 1.413391 
1 1 1   33   14    1 o 13.81981 3.567211   17.95982   137.2   2.135122 0.9923807          ?        ? 
1 1 1   33   14    2 o 11.97576 3.865665   10.02493    12.9   1.563751 1.052525          ?        ? 
1 1 1   33   14    3 o 17.90347 2.855461   31.72332   138.7   3.368080 1.022453          ?        ? 
1 1 1   33   14    4 o 6.822639 3.193156   14.68308   246.6 -0.9021643 1.082597          ?        ? 
1 1 1   33   14    5 f 11.88678 3.536530   25.21618   304.3   1.563751 0.9021643          ?        ? 
1 1 1   33   14    6 o 6.401160 2.983403   12.82977   226.5 -0.7217315 0.9322364          ?        ? 
1 1 1   33   14    7 o 13.61696 3.334697   18.78528   249.9   2.105050 0.9021643          ?        ? 
1 1 1   33   14    8 o 8.777482 3.383470   18.23675   232.6  0.6615872 0.8420200          ?        ? 
1 1 1   33   14    9 o 17.20532 3.773457   27.26054   113.7   3.548513 1.263030          ?        ? 
1 1 1   33   14   10 o 9.049809 3.859739   21.25889   108.3  0.4510822 1.232958          ?        ? 
1 1 1   33   15    0 o 16.85286 5.211864   13.52450   180.0   3.728946 1.533679   3.728946 1.533679 
1 1 1   33   15    1 o 9.962786 3.759598   19.23179   297.1  0.8720922 1.022453          ?        ? 
1 1 1   33   15    2 o 15.39599 3.317600   19.77331     6.3   2.616277 0.9923807          ?        ? 
1 1 1   33   15    3 o 9.362918 3.736468   8.570170   265.4  0.6014429 1.052525          ?        ? 
1 1 1   33   15    4 o 25.67945 1.990800   35.74637   150.5   6.766232 1.022453          ?        ? 
1 1 1   33   15    5 o 7.062125 3.210763   4.938169    48.6 -0.4510822 0.9923807          ?        ? 
1 1 1   33   15    6 o 7.126943 3.185408   8.457079   280.4 -0.2405772 0.9322364          ?        ? 
1 1 1   33   15    7 o 13.38669 3.369594   13.63041   345.0   2.044906 0.9021643          ?        ? 
1 1 1   33   15    8 o 11.61830 3.481254   20.98926   350.7   1.563751 0.8720922          ?        ? 
1 1 1   33   15    9 o 11.94266 4.222713   21.58171   100.4   1.714112 1.263030          ?        ? 
1 1 1   33   16    0 o 7.199737 4.661621   21.99588   180.0  0.2105050 1.533679  0.2105050 1.533679 
1 1 1   33   16    1 o 8.599769 3.583173   25.41239   195.8  0.3007214 1.022453          ?        ? 
1 1 1   33   16    2 o 12.13441 3.796897   18.26806    30.1   1.623896 1.022453          ?        ? 
1 1 1   33   16    3 o 18.26003 2.882047   31.39387   113.3   3.518441 1.052525          ?        ? 
1 1 1   33   16    4 o 9.209513 3.603167   14.63961   239.7  0.6615872 0.9623086          ?        ? 
1 1 1   33   16    5 o 9.548848 3.634401   9.352949   193.8  0.8119479 0.9623086          ?        ? 
1 1 1   33   16    6 o 11.94648 3.532669   21.46080   338.5   1.623896 0.9021643          ?        ? 
1 1 1   33   16    7 o 7.754546 3.333267   17.37271   297.4  0.1202886 0.9322364          ?        ? 
1 1 1   33   16    8 o 8.981449 3.447759   20.23121   333.6  0.7518036 0.8720922          ?        ? 
1 1 1   33   16    9 o 11.07089 4.178324   8.754348    23.5   1.383319 1.263030          ?        ? 
1 1 1   33   17    0 o 6.089590 4.062551   7.713828   180.0 -0.1804329 1.293102 -0.1804329 1.293102 
1 1 1   33   17    1 o 17.29524 2.608129   13.24592   197.9   3.127503 0.9021643          ?        ? 
1 1 1   33   17    2 o 8.510924 3.622912   11.79576   223.8  0.1804329 1.082597          ?        ? 
1 1 1   33   17    3 f 8.545141 3.629754   5.508068   181.4  0.2105050 1.082597          ?        ? 
1 1 1   33   17    4 o 17.64711 2.556124   27.81672   159.1   3.277864 0.9021643          ?        ? 
1 1 1   33   17    5 o 6.074265 2.857419   7.002603   285.5 -0.8420200 0.9021643          ?        ? 
1 1 1   33   17    6 o 11.23053 3.698272   21.04284    75.9   1.413391 0.9623086          ?        ? 
1 1 1   33   17    7 o 13.92696 3.551201   26.51069   213.2   2.285483 0.9923807          ?        ? 
1 1 1   33   17    8 o 17.49550 2.578275   28.40829    64.3   3.307936 0.9021643          ?        ? 
1 1 1   33   18    0 o 26.83730 3.095644   49.12016   180.0   7.728541 1.623896   7.728541 1.623896 
1 1 1   33   18    1 o 8.040080 3.524297   25.03494   272.0      -0.06 1.082597          ?        ? 
1 1 1   33   18    2 o 13.34158 3.845951   14.26673   255.8   2.044906 1.082597          ?        ? 
1 1 1   33   18    3 o 11.57188 3.626446   13.28888   262.8   1.503607 0.9322364          ?        ? 
1 1 1   33   18    4 o 8.524623 3.470487   5.741161   110.5  0.4510822 0.9322364          ?        ? 
1 1 1   33   18    5 o 8.096690 3.400170   5.091117    19.1  0.2706493 0.9322364          ?        ? 
1 1 1   33   18    6 o 4.915108 2.443029   11.88534   137.2  -2.105050 0.9322364          ?        ? 
1 1 1   33   18    7 o 17.02758 2.737431   18.70619   330.3   3.157575 0.9322364          ?        ? 
1 1 1   33   18    8 o 10.87566 3.698276   26.09932   356.2   1.383319 0.9623086          ?        ? 
1 1 1   33   19    0 o 15.50198 5.538956   26.53234   180.0   3.428224 1.563751   3.428224 1.563751 
1 1 1   33   19    1 o 15.84251 3.509767   23.06871   307.4   2.856854 1.082597          ?        ? 
1 1 1   33   19    2 o 9.561723 3.547206   14.83820   114.2  0.8720922 0.9021643          ?        ? 
1 1 1   33   19    3 o 12.03043 3.667428   28.39485   205.2   1.653968 0.9623086          ?        ? 
1 1 1   33   19    4 o 13.64965 3.666673   19.36647   309.5   2.165194 1.022453          ?        ? 
1 1 1   33   19    5 o 14.19523 3.510545   26.91438   282.4   2.345627 0.9923807          ?        ? 
1 1 1   33   19    6 o 23.99198 2.068151   44.89079   181.5   6.044501 0.9923807          ?        ? 
1 1 1   33   19    7 f 10.33421 3.630473   18.25443   276.3   1.202886 0.9322364          ?        ? 
1 1 1   33   20    0 f 20.47103 3.936940   26.54116     0.0   4.841615 1.443463   4.841615 1.443463 
1 1 1   33   20    1 o 11.68339 3.922610   16.98203   195.6   1.533679 1.082597          ?        ? 
1 1 1   33   20    2 o 10.21408 3.518709   20.77464   168.2   1.112669 0.8720922          ?        ? 
1 1 1   33   20    3 o 9.300327 3.691735   15.25917   151.8  0.6916593 1.022453          ?        ? 
1 1 1   33   20    4 o 16.12661 3.190342   29.82180   264.9   2.947070 0.9923807          ?        ? 
1 1 1   33   20    5 f 21.34117 2.325039   31.95656    93.8   4.841615 0.9923807          ?        ? 
1 1 1   33   20    6 o 6.882907 3.124656   7.541843   289.0 -0.3007214 0.9322364          ?        ? 
1 1 1   33   21    0 o 6.466413 4.369340   7.996946     0.0 -0.3307936 1.593824 -0.3307936 1.593824 
1 1 1   33   21    1 o 15.50314 3.299145   15.88524    89.9   2.736565 0.9923807          ?        ? 
1 1 1   33   21    2 o 12.85961 3.818651   24.64038   271.1   1.954689 1.052525          ?        ? 
1 1 1   33   21    3 o 8.720610 3.605142   12.12946   151.4  0.4811543 1.022453          ?        ? 
1 1 1   33   21    4 o 8.274098 3.492960   7.527746   202.9  0.3307936 0.9923807          ?        ? 
1 1 1   33   21    5 o 23.58648 2.103707   40.57191    95.4   5.864068 0.9923807          ?        ? 
1 1 1   33   21    6 o 6.758357 3.122112   16.54090   244.0 -0.5112265 0.9923807          ?        ? 
1 1 1   33   22    0 o 16.76298 4.368811   29.16999     0.0   3.548513 1.263030   3.548513 1.263030 
1 1 1   33   22    1 o 7.732511 3.445002   12.63876    63.6 -0.1202886 1.082597          ?        ? 
1 1 1   33   22    2 o 6.476020 3.023265   12.94571   307.0 -0.6615872 0.9623086          ?        ? 
1 1 1   33   22    3 o 8.473325 3.559735   15.39552   221.1  0.3909379 1.022453          ?        ? 
1 1 1   33   22    4 o 24.25274 2.169909   48.91532   335.5   6.224934 1.052525          ?        ? 
1 1 1   33   22    5 o 12.43528 3.778203   16.40861   215.0   1.894545 1.022453          ?        ? 
1 1 1   33   23    0 o 6.840608 4.483768   10.69664     0.0  0.2105050 1.473535  0.2105050 1.473535 
1 1 1   33   23    1 o 11.57824 3.922614   13.85319   174.6   1.593824 1.082597          ?        ? 
1 1 1   33   23    2 o 7.618643 3.331266   15.47935    91.6       0.06 0.9623086          ?        ? 
1 1 1   33   23    3 o 18.28368 2.631606   21.73556   284.2   3.638730 0.9623086          ?        ? 
1 1 1   33   24    0 o 6.540042 4.290869   2.176313   180.0  0.1804329 1.353247  0.1804329 1.353247 
1 1 1   33   24    1 o 13.40078 3.537963   20.74299   141.5   2.165194 0.9623086          ?        ? 
1 1 1   34    0    0 o 21.02246 5.387347   26.57378   180.0   5.322770 1.954689   5.322770 1.954689 
1 1 1   34    0    1 o 8.987659 5.184327   4.776639     0.0   1.172814 1.473535   1.172814 1.473535 
1 1 1   34    0    2 o 10.21215 5.418376   33.36255     0.0   1.653968 1.473535   1.653968 1.473535 
1 1 1   34    0    3 o 14.51643 5.528836   33.92946   180.0   3.007215 1.503607   3.007215 1.503607 
1 1 1   34    0    4 o 15.69630 5.946347   22.02695   180.0   3.548513 1.744184   3.548513 1.744184 
1 1 1   34    0    5 o 14.83304 6.024989   27.60324   180.0   3.307936 1.744184   3.307936 1.744184 
1 1 1   34    0    6 o 20.47044 4.345735   34.26534   180.0   4.901759 1.563751   4.901759 1.563751 
1 1 1   34    0    7 o 7.816321 4.873032   18.62269     0.0  0.6315150 1.503607  0.6315150 1.503607 
1 1 1   34    0    8 o 6.210547 4.157925   19.26183     0.0 -0.2105050 1.383319 -0.2105050 1.383319 
1 1 1   34    0    9 o 7.743141 4.903982   3.293484     0.0  0.5713707 1.593824  0.5713707 1.593824 
1 1 1   34    0   10 o 7.469263 4.508676   23.18077     0.0  0.7818757 1.202886  0.7818757 1.202886 
1 1 1   34    0   11 o 10.69076 6.657280   5.866941   180.0   2.105050 2.796710   2.105050 2.796710 
1 1 1   34    1    0 o 8.023456 4.912456   3.078235     0.0  0.7217315 1.473535  0.7217315 1.473535 
1 1 1   34    1    1 o 20.75670 2.535387   37.14253   334.7   4.450677 1.052525          ?        ? 
1 1 1   34    1    2 o 9.566464 3.719937   4.752962    51.1  0.6916593 1.022453          ?        ? 
1 1 1   34    1    3 o 8.389508 3.484647   21.88546   262.2  0.2706493 0.9623086          ?        ? 
1 1 1   34    1    4 o 14.75566 3.758943   28.27277   197.3   2.435844 1.112669          ?        ? 
1 1 1   34    1    5 o 22.90448 2.625874   47.41600   348.5   5.473131 1.202886          ?        ? 
1 1 1   34    1    6 o 8.450872 3.583866   24.35103   239.0  0.1804329 1.052525          ?        ? 
1 1 1   34    1    7 f 17.13294 3.367148   41.61762   318.5   3.247792 1.112669          ?        ? 
1 1 1   34    1    8 o 8.225180 3.538867   9.082246   307.5  0.1202886 1.052525          ?        ? 
1 1 1   34    1    9 o 15.16687 3.360566   10.53459   345.3   2.616277 0.9923807          ?        ? 
1 1 1   34    1   10 o 19.98004 2.934964   28.69180   342.3   4.390533 1.172814          ?        ? 
1 1 1   34    1   11 o 9.353722 4.209668   8.912009   144.3       0.03 1.653968          ?        ? 
1 1 1   34    2    0 o 11.51827 5.604673   27.18184     0.0   2.105050 1.503607   2.105050 1.503607 
1 1 1   34    2    1 o 7.941110 3.478000   23.90264    30.9 -0.1202886 1.052525          ?        ? 
1 1 1   34    2    2 o 10.99574 4.003610   23.79818   153.6   1.142741 1.142741          ?        ? 
1 1 1   34    2    3 o 16.84152 3.588450   31.30123   319.3   3.127503 1.172814          ?        ? 
1 1 1   34    2    4 o 15.28529 3.759152   21.53971   332.0   2.616277 1.142741          ?        ? 
1 1 1   34    2    5 o 9.303734 3.758168   21.58844   317.4  0.5412986 1.082597          ?        ? 
1 1 1   34    2    6 o 14.87883 3.492107   26.46836   245.1   2.465916 1.022453          ?        ? 
1 1 1   34    2    7 o 11.82291 4.030102   19.07697   246.4   1.503607 1.142741          ?        ? 
1 1 1   34    2    8 o 16.37024 3.330453   26.28888    41.3   3.007215 1.052525          ?        ? 
1 1 1   34    2    9 o 5.777844 2.753888   9.995623   341.1 -0.9623086 0.8720922          ?        ? 
1 1 1   34    2   10 o 9.426186 3.778582   13.89914     7.6  0.7518036 1.082597          ?        ? 
1 1 1   34    2   11 o 13.51452 3.683059   24.94853   313.8   2.225339 1.022453          ?        ? 
1 1 1   34    3    0 o 23.74800 3.057054   34.74103   180.0   6.044501 1.413391   6.044501 1.413391 
1 1 1   34    3    1 o 12.74572 3.955411   22.18527    46.8   1.774257 1.112669          ?        ? 
1 1 1   34    3    2 o 12.26090 4.082779   24.54818    93.2   1.593824 1.172814          ?        ? 
1 1 1   34    3    3 o 7.350039 3.358710   14.97869   322.8 -0.6315150 1.112669          ?        ? 
1 1 1   34    3    4 o 14.47368 3.720098   27.51781    89.2   2.345627 1.082597          ?        ? 
1 1 1   34    3    5 o 23.43749 2.694465   37.05270   144.0   5.743780 1.263030          ?        ? 
1 1 1   34    3    6 o 16.26227 3.768947   28.28969   152.6   2.977142 1.202886          ?        ? 
1 1 1   34    3    7 o 14.32526 3.575984   31.65093   328.6   2.315555 1.022453          ?        ? 
1 1 1   34    3    8 o 19.29774 2.804985   35.52735     7.0   3.969523 1.082597          ?        ? 
1 1 1   34    3    9 o 10.06365 3.928684   9.601872   263.4  0.9021643 1.142741          ?        ? 
1 1 1   34    3   10 o 13.10017 3.797300   22.65753   115.7   2.074978 1.052525          ?        ? 
1 1 1   34    3   11 o 10.20231 3.625767   7.688790   206.5   1.172814 0.9322364          ?        ? 
1 1 1   34    4    0 o 20.21095 4.013879   13.27983   180.0   4.661182 1.443463   4.661182 1.443463 
1 1 1   34    4    1 o 10.63909 3.744931   5.801848   197.3   1.112669 0.9923807          ?        ? 
1 1 1   34    4    2 o 17.01200 3.390423   36.30153   258.5   3.157575 1.112669          ?        ? 
1 1 1   34    4    3 o 9.349118 3.734739   14.49746    39.4  0.5713707 1.052525          ?        ? 
1 1 1   34    4    4 o 7.158715 3.288663   15.59439   303.7 -0.6615872 1.082597          ?        ? 
1 1 1   34    4    5 o 14.22303 3.826969   21.40065   171.2   2.285483 1.112669          ?        ? 
1 1 1   34    4    6 o 16.50360 3.563378   15.82230   167.6   3.037287 1.142741          ?        ? 
1 1 1   34    4    7 o 16.05293 3.470306   22.41052   164.8   2.886926 1.082597          ?        ? 
1 1 1   34    4    8 o 13.57891 3.752934   31.96705   141.9   2.135122 1.052525          ?        ? 
1 1 1   34    4    9 o 13.59951 4.029442   26.33752   175.8   2.195267 1.172814          ?        ? 
1 1 1   34    4   10 o 10.89741 4.000097   10.72035    31.9   1.323174 1.142741          ?        ? 
1 1 1   34    5    0 o 36.33578 2.379575   57.17530   360.0   13.56254 1.714112   13.56254 1.714112 
1 1 1   34    5    1 o 18.62541 3.067695   23.63040   192.0   3.638730 1.142741          ?        ? 
1 1 1   34    5    2 o 11.50777 3.973545   36.20227   277.9   1.353247 1.112669          ?        ? 
1 1 1   34    5    3 o 12.06027 3.922609   23.33667   160.3   1.563751 1.082597          ?        ? 
1 1 1   34    5    4 o 8.859329 3.688918   23.08205   127.0  0.3307936 1.082597          ?        ? 
1 1 1   34    5    5 o 14.43651 3.725565   17.89056    85.8   2.345627 1.082597          ?        ? 
1 1 1   34    5    6 o 14.45120 3.947371   19.52600    55.2   2.375700 1.172814          ?        ? 
1 1 1   34    5    7 o 21.55303 2.581236   35.83740    54.5   4.871688 1.112669          ?        ? 
1 1 1   34    5    8 o 7.036760 3.217265   14.70834    87.7 -0.5112265 1.022453          ?        ? 
1 1 1   34    5    9 o 9.024264 3.717803   17.73218   223.2  0.5112265 1.082597          ?        ? 
1 1 1   34    5   10 o 10.62079 3.794879   15.08636   227.4   1.263030 1.022453          ?        ? 
1 1 1   34    6    0 o 8.247628 5.127583   17.11950   360.0  0.6916593 1.653968  0.6916593 1.653968 
1 1 1   34    6    1 o 16.13110 3.942743   23.97340   116.4   2.916998 1.263030          ?        ? 
1 1 1   34    6    2 o 11.98454 3.922611   10.67770   343.5   1.533679 1.082597          ?        ? 
1 1 1   34    6    3 o 13.69571 4.020873   15.48547   134.9   2.105050 1.172814          ?        ? 
1 1 1   34    6    4 o 11.30902 4.108603   17.23076     4.4   1.263030 1.202886          ?        ? 
1 1 1   34    6    5 o 8.265904 3.644380   11.02751   280.5 -0.1503607 1.172814          ?        ? 
1 1 1   34    6    6 o 6.346909 3.055293   8.184755   301.7  -1.533679 1.142741          ?        ? 
1 1 1   34    6    7 o 8.809411 3.650777   17.48860   275.7  0.3909379 1.052525          ?        ? 
1 1 1   34    6    8 o 5.732095 2.769591   11.26678   181.0  -1.353247 0.9623086          ?        ? 
1 1 1   34    6    9 o 8.242107 3.637771   11.28054    83.9      -0.03 1.172814          ?        ? 
1 1 1   34    6   10 o 10.88522 3.854188   9.721936    19.7   1.353247 1.052525          ?        ? 
1 1 1   34    7    0 o 18.04823 5.013960   36.69513     0.0   4.089812 1.563751   4.089812 1.563751 
1 1 1   34    7    1 o 11.69985 4.028135   10.95044   338.9   1.413391 1.142741          ?        ? 
1 1 1   34    7    2 o 9.199040 3.807629   21.05655   177.8  0.3909379 1.142741          ?        ? 
1 1 1   34    7    3 o 22.29856 2.562366   28.57516   335.0   5.172409 1.142741          ?        ? 
1 1 1   34    7    4 o 9.432759 3.745213   17.89565   241.7  0.6315150 1.052525          ?        ? 
1 1 1   34    7    5 o 6.867087 3.218110   4.194214   116.0 -0.9623086 1.112669          ?        ? 
1 1 1   34    7    6 o 9.163209 3.771059   10.70055   359.0  0.4510822 1.112669          ?        ? 
1 1 1   34    7    7 o 12.11876 3.921363   3.182209   352.1   1.653968 1.082597          ?        ? 
1 1 1   34    7    8 o 6.442348 3.013638   12.52860   280.4 -0.7518036 0.9623086          ?        ? 
1 1 1   34    7    9 o 8.318871 3.633860   10.41148    44.4       0.09 1.142741          ?        ? 
1 1 1   34    7   10 o 16.51071 3.394890   19.51811   180.1   3.187647 1.082597          ?        ? 
1 1 1   34    8    0 o 8.556405 5.315071   19.36195   180.0  0.7818757 1.774257  0.7818757 1.774257 
1 1 1   34    8    1 o 20.88564 2.663718   33.83955   114.8   4.540894 1.112669          ?        ? 
1 1 1   34    8    2 o 11.36667 3.867750   9.405635   356.3   1.353247 1.052525          ?        ? 
1 1 1   34    8    3 o 7.766768 3.532140   17.70702   250.0 -0.5412986 1.202886          ?        ? 
1 1 1   34    8    4 o 9.608451 3.869448   12.94634   101.5  0.6014429 1.142741          ?        ? 
1 1 1   34    8    5 o 9.180491 3.885366   9.443172   113.7  0.2706493 1.232958          ?        ? 
1 1 1   34    8    6 o 11.02447 3.956800   12.28538   218.9   1.232958 1.112669          ?        ? 
1 1 1   34    8    7 o 16.26093 3.520691   20.17899   152.7   3.007215 1.112669          ?        ? 
1 1 1   34    8    8 o 17.04878 2.469444   25.16695   304.7   3.067359 0.8420200          ?        ? 
1 1 1   34    8    9 o 7.708998 3.501020   19.99766    32.3 -0.3307936 1.172814          ?        ? 
1 1 1   34    8   10 o 6.884555 3.224828   4.568947    95.4 -0.7518036 1.112669          ?        ? 
1 1 1   34    9    0 f 13.43284 5.680024   11.42241     0.0   2.736565 1.533679   2.736565 1.533679 
1 1 1   34    9    1 o 12.00021 4.082787   24.93380   298.6   1.533679 1.172814          ?        ? 
1 1 1   34    9    2 o 14.78578 3.754379   32.31657   137.2   2.465916 1.112669          ?        ? 
1 1 1   34    9    3 o 14.94173 3.566473   12.95030    87.2   2.495988 1.052525          ?        ? 
1 1 1   34    9    4 o 14.43569 3.725664   36.39312   227.9   2.345627 1.082597          ?        ? 
1 1 1   34    9    5 o 13.44025 3.907008   22.62372    57.1   2.044906 1.112669          ?        ? 
1 1 1   34    9    6 o 18.53851 3.000968   26.79304   185.3   3.668802 1.112669          ?        ? 
1 1 1   34    9    7 o 12.90127 3.815943   26.20528   263.2   1.924617 1.052525          ?        ? 
1 1 1   34    9    8 o 14.38395 3.022779   28.29842   225.2   2.315555 0.8420200          ?        ? 
1 1 1   34    9    9 o 7.701618 3.510417   4.524122   315.4 -0.3909379 1.202886          ?        ? 
1 1 1   34    9   10 o 6.830863 3.214085   10.74474   235.4 -0.8720922 1.142741          ?        ? 
1 1 1   34   10    0 o 6.726824 4.471602   7.719872   360.0 -0.1202886 1.533679 -0.1202886 1.533679 
1 1 1   34   10    1 o 6.366739 3.042578   9.454997   120.0  -1.293102 1.082597          ?        ? 
1 1 1   34   10    2 o 7.768960 3.497631   10.23554   355.7 -0.3909379 1.142741          ?        ? 
1 1 1   34   10    3 o 12.48745 4.027642   6.917369   221.6   1.714112 1.142741          ?        ? 
1 1 1   34   10    4 o 12.71995 3.957022   20.45822   265.9   1.804329 1.112669          ?        ? 
1 1 1   34   10    5 f 16.80515 3.339666   20.14850    44.5   3.127503 1.082597          ?        ? 
1 1 1   34   10    6 o 8.470536 3.587612   2.287915    92.6  0.2405772 1.052525          ?        ? 
1 1 1   34   10    7 o 10.10659 3.890742   5.385726    90.4  0.9322364 1.112669          ?        ? 
1 1 1   34   10    8 o 18.22615 2.227426   24.44254   358.2   3.488369 0.8119479          ?        ? 
1 1 1   34   10    9 o 7.482913 3.401464   8.990324    78.3 -0.3307936 1.112669          ?        ? 
1 1 1   34   11    0 o 6.618434 4.376182   4.291674     0.0      -0.06 1.443463      -0.06 1.443463 
1 1 1   34   11    1 o 18.83530 3.642482   33.28940   117.4   3.939451 1.323174          ?        ? 
1 1 1   34   11    2 o 21.23584 2.548986   39.53716   240.5   4.691255 1.082597          ?        ? 
1 1 1   34   11    3 o 6.986782 3.279525   5.018106   205.0  -1.052525 1.172814          ?        ? 
1 1 1   34   11    4 o 17.22172 3.174940   18.96669   314.7   3.247792 1.052525          ?        ? 
1 1 1   34   11    5 o 13.54428 3.897251   13.87146   345.6   2.105050 1.112669          ?        ? 
1 1 1   34   11    6 o 8.363234 3.593373   17.29437   135.2  0.1503607 1.082597          ?        ? 
1 1 1   34   11    7 o 16.13943 3.000253   23.53150   104.9   2.886926 0.9322364          ?        ? 
1 1 1   34   11    8 o 9.046576 3.412390   15.26419   198.4  0.7818757 0.8420200          ?        ? 
1 1 1   34   11    9 o 6.568450 3.164794   7.810292    84.9  -1.443463 1.232958          ?        ? 
1 1 1   34   12    0 f 7.378896 4.715880   10.64827   180.0  0.3608657 1.503607  0.3608657 1.503607 
1 1 1   34   12    1 o 9.268299 3.650254   19.41559   144.3  0.6315150 0.9923807          ?        ? 
1 1 1   34   12    2 o 9.936933 3.795446   18.00406   266.1  0.8420200 1.052525          ?        ? 
1 1 1   34   12    3 o 11.75585 4.029994   12.96013   215.7   1.473535 1.142741          ?        ? 
1 1 1   34   12    4 o 9.284060 3.821386   11.77436   255.4  0.4811543 1.142741          ?        ? 
1 1 1   34   12    5 o 11.83924 3.922608   16.79097   228.7   1.563751 1.082597          ?        ? 
1 1 1   34   12    6 o 15.01471 3.719682   12.94594    43.6   2.616277 1.112669          ?        ? 
1 1 1   34   12    7 o 6.554205 3.027124   11.30596   124.1 -0.5713707 0.9322364          ?        ? 
1 1 1   34   12    8 o 21.97479 1.984302   47.59001   158.6   5.052120 0.8720922          ?        ? 
1 1 1   34   12    9 o 8.874612 3.848083   8.665314   355.6  0.3007214 1.263030          ?        ? 
1 1 1   34   13    0 o 5.722440 3.986652   1.693216   360.0  -1.082597 1.563751  -1.082597 1.563751 
1 1 1   34   13    1 o 18.72421 2.890902   36.09121   219.9   3.698874 1.082597          ?        ? 
1 1 1   34   13    2 o 11.93507 3.866971   21.58901   154.0   1.563751 1.052525          ?        ? 
1 1 1   34   13    3 o 16.92322 3.225588   33.84509   139.9   3.157575 1.052525          ?        ? 
1 1 1   34   13    4 o 16.62316 3.542308   33.59391   146.6   3.127503 1.142741          ?        ? 
1 1 1   34   13    5 o 15.32242 3.832949   20.37906   133.4   2.736565 1.172814          ?        ? 
1 1 1   34   13    6 o 11.40995 3.565835   14.31439   286.5   1.473535 0.9021643          ?        ? 
1 1 1   34   13    7 o 8.787841 3.513161   14.70965    45.8  0.6014429 0.9322364          ?        ? 
1 1 1   34   13    8 o 6.438811 2.935418   5.076161   182.7 -0.3608657 0.8420200          ?        ? 
1 1 1   34   14    0 o 4.716955 3.414063   10.78621   180.0  -2.195267 1.503607  -2.195267 1.503607 
1 1 1   34   14    1 o 19.13160 2.907936   29.09987    48.0   3.879307 1.112669          ?        ? 
1 1 1   34   14    2 o 15.66061 3.539375   24.82409    48.5   2.766637 1.082597          ?        ? 
1 1 1   34   14    3 o 14.56923 3.705626   23.89123   127.6   2.435844 1.082597          ?        ? 
1 1 1   34   14    4 o 27.45892 1.971303   27.06529   285.9   7.788685 1.082597          ?        ? 
1 1 1   34   14    5 o 16.99657 3.302607   25.22458   239.3   3.247792 1.082597          ?        ? 
1 1 1   34   14    6 o 17.76781 2.623386   22.61785   223.9   3.368080 0.9322364          ?        ? 
1 1 1   34   14    7 o 6.194440 2.901967   2.739050   275.1 -0.6916593 0.9021643          ?        ? 
1 1 1   34   14    8 o 8.483726 3.501767   17.15009   271.9  0.4811543 0.9623086          ?        ? 
1 1 1   34   15    0 o 8.679544 5.015944   21.10924   180.0   1.142741 1.383319   1.142741 1.383319 
1 1 1   34   15    1 o 14.34819 3.572508   18.12527   303.8   2.345627 1.022453          ?        ? 
1 1 1   34   15    2 o 7.348604 3.329884   16.66830   128.4 -0.3909379 1.052525          ?        ? 
1 1 1   34   15    3 o 15.46119 3.570471   24.89946   294.2   2.736565 1.082597          ?        ? 
1 1 1   34   15    4 o 15.09804 3.542789   19.77774   122.3   2.616277 1.052525          ?        ? 
1 1 1   34   15    5 o 20.24923 2.450416   36.29520   275.6   4.330389 0.9923807          ?        ? 
1 1 1   34   15    6 o 9.129608 3.666955   19.43195   188.7  0.6615872 1.022453          ?        ? 
1 1 1   34   15    7 o 6.224919 2.913683   12.72211   241.2 -0.6615872 0.9021643          ?        ? 
1 1 1   34   15    8 o 9.445623 3.666494   4.455466    72.9  0.8720922 0.9923807          ?        ? 
1 1 1   34   16    0 o 12.01794 5.918000   29.64913   180.0   2.435844 1.684040   2.435844 1.684040 
1 1 1   34   16    1 o 5.899603 2.859088   11.75171   177.7  -1.563751 1.052525          ?        ? 
1 1 1   34   16    2 o 7.716725 3.402437   9.378289   112.9      -0.09 1.022453          ?        ? 
1 1 1   34   16    3 o 8.134838 3.519849   19.43116   329.5       0.09 1.052525          ?        ? 
1 1 1   34   16    4 f 19.98832 2.407177   32.03037   137.7   4.210100 0.9623086          ?        ? 
1 1 1   34   16    5 o 14.06588 3.530149   25.15396   105.7   2.315555 0.9923807          ?        ? 
1 1 1   34   16    6 f 6.987083 3.127972   5.896293   313.1 -0.1804329 0.9021643          ?        ? 
1 1 1   34   16    7 o 8.180543 3.384435   13.95662   272.0  0.4210100 0.9021643          ?        ? 
1 1 1   34   17    0 o 6.697445 4.489842   16.46447     0.0 -0.2105050 1.623896 -0.2105050 1.623896 
1 1 1   34   17    1 o 6.275592 2.987061   6.176667   283.1  -1.082597 1.022453          ?        ? 
1 1 1   34   17    2 o 10.24788 3.781361   18.11746   154.9   1.052525 1.022453          ?        ? 
1 1 1   34   17    3 o 7.679804 3.410556   7.976334   190.4 -0.1503607 1.052525          ?        ? 
1 1 1   34   17    4 o 8.096184 3.400074   19.46934   286.3  0.3007214 0.9322364          ?        ? 
1 1 1   34   17    5 o 9.370802 3.700544   12.42545   157.6  0.7818757 1.022453          ?        ? 
1 1 1   34   17    6 f 11.29030 3.698274   20.15265   153.9   1.503607 0.9623086          ?        ? 
1 1 1   34   18    0 o 6.502389 4.293637   15.51046   360.0       0.03 1.383319       0.03 1.383319 
1 1 1   34   18    1 o 6.585222 3.094464   8.315161   313.3 -0.9021643 1.052525          ?        ? 
1 1 1   34   18    2 o 12.58484 3.835299   16.51877   196.6   1.864473 1.052525          ?        ? 
1 1 1   34   18    3 o 12.97212 3.589920   16.18894   147.3   1.984761 0.9623086          ?        ? 
1 1 1   34   18    4 o 9.637233 3.552555   18.49937   354.7  0.9623086 0.9021643          ?        ? 
1 1 1   34   18    5 o 22.85128 2.105591   35.94821    45.5   5.503202 0.9623086          ?        ? 
1 1 1   34   18    6 o 20.39795 2.432550   27.71508   326.9   4.480750 0.9923807          ?        ? 
1 1 1   34   19    0 o 9.926831 5.546563   12.44792   180.0   1.714112 1.623896   1.714112 1.623896 
1 1 1   34   19    1 o 12.72977 3.956408   17.80892    53.4   1.954689 1.112669          ?        ? 
1 1 1   34   19    2 o 10.81738 3.949411   15.93266   292.8   1.293102 1.112669          ?        ? 
1 1 1   34   19    3 o 7.684805 3.371371   7.648810    38.2       0.03 0.9923807          ?        ? 
1 1 1   34   19    4 o 8.231279 3.455535   5.619311    95.4  0.3608657 0.9623086          ?        ? 
1 1 1   34   19    5 o 7.761578 3.305692   14.80148   312.7  0.2405772 0.9021643          ?        ? 
1 1 1   34   20    0 o 14.37482 5.472686   27.39205     0.0   3.127503 1.473535   3.127503 1.473535 
1 1 1   34   20    1 o 7.209362 3.251801   16.43447    43.6 -0.2405772 0.9923807          ?        ? 
1 1 1   34   20    2 o 10.82586 3.901229   24.02480   323.4   1.323174 1.082597          ?        ? 
1 1 1   34   20    3 o 13.65907 3.505350   17.03477     7.8   2.225339 0.9623086          ?        ? 
1 1 1   34   20    4 o 12.08199 3.732681   25.56242     8.7   1.774257 0.9923807          ?        ? 
1 1 1   34   21    0 o 7.846013 4.960085   4.559964     0.0  0.7217315 1.623896  0.7217315 1.623896 
1 1 1   34   21    1 o 8.749148 3.539486   9.753486   283.4  0.6014429 0.9623086          ?        ? 
1 1 1   34   21    2 o 7.032421 3.200857   13.62522    95.7 -0.3307936 0.9923807          ?        ? 
1 1 1   35    0    1 o 8.541084 5.264060   25.73476    90.0  0.8420200 1.714112  0.8420200 1.714112 
1 1 1   35    0    2 o 8.565762 5.339438   6.575294   270.0  0.7818757 1.804329  0.7818757 1.804329 
1 1 1   35    0    3 f 8.005361 5.153518   18.92558   270.0  0.3909379 1.834401  0.3909379 1.834401 
1 1 1   35    0    4 o 49.79956 1.664705   80.92233   270.0   25.11024 1.653968   25.11024 1.653968 
1 1 1   35    0    5 o 25.09686 3.584248   18.41224   270.0   6.796305 1.744184   6.796305 1.744184 
1 1 1   35    0    6 o 13.34752 5.915934   21.06378   270.0   2.856854 1.653968   2.856854 1.653968 
1 1 1   35    0    7 o 4.822011 3.488955   5.664310    90.0  -2.195267 1.563751  -2.195267 1.563751 
1 1 1   35    0    8 o 10.95409 5.417102   16.10194    90.0   2.044906 1.413391   2.044906 1.413391 
1 1 1   35    0    9 f 6.355718 4.620169   2.125095    90.0  -3.969523 2.947070  -3.969523 2.947070 
1 1 1   35    1    0 o 9.455033 6.058644   16.90167   180.0  0.7518036 2.495988  0.7518036 2.495988 
1 1 1   35    1    1 o 20.79284 3.037176   37.78622    71.8   4.570966 1.263030          ?        ? 
1 1 1   35    1    2 o 16.64497 4.234379   18.66657   270.4   3.187647 1.413391          ?        ? 
1 1 1   35    1    3 o 9.864186 3.787366   20.28369    20.5  0.8119479 1.052525          ?        ? 
1 1 1   35    1    4 o 14.13611 4.047157   24.33746   107.6   2.285483 1.202886          ?        ? 
1 1 1   35    1    5 o 15.05514 3.946765   10.87012    58.4   2.616277 1.202886          ?        ? 
1 1 1   35    1    6 o 11.37444 3.920254   11.49113   126.1   1.413391 1.082597          ?        ? 
1 1 1   35    1    7 o 7.707507 3.350695   10.94391   269.4       0.03 0.9623086          ?        ? 
1 1 1   35    1    8 o 19.68788 3.054889   40.52052   283.2   4.270245 1.202886          ?        ? 
1 1 1   35    1    9 o 13.37015 3.913583   14.49343   172.9   2.195267 1.112669          ?        ? 
1 1 1   35    2    0 f 11.22354 5.627728   45.03818     0.0   2.044906 1.533679   2.044906 1.533679 
1 1 1   35    2    1 o 10.73495 4.032055   17.23526   358.8   1.052525 1.172814          ?        ? 
1 1 1   35    2    2 o 17.49733 3.561001   41.82223   210.8   3.398152 1.202886          ?        ? 
1 1 1   35    2    3 o 5.466588 2.700266   15.05828   176.3  -2.285483 1.082597          ?        ? 
1 1 1   35    2    4 o 26.43974 2.047292   38.92590    67.9   7.187243 1.082597          ?        ? 
1 1 1   35    2    5 o 14.64472 3.850372   18.50672   166.7   2.465916 1.142741          ?        ? 
1 1 1   35    2    6 o 11.33554 4.109549   18.49794    97.0   1.353247 1.202886          ?        ? 
1 1 1   35    2    7 o 6.125929 2.971996   21.93544   167.1  -1.684040 1.142741          ?        ? 
1 1 1   35    2    8 o 7.525052 3.415508   14.18493   191.7 -0.3307936 1.112669          ?        ? 
1 1 1   35    2    9 o 7.511287 3.457315   8.636147    55.6 -0.5112265 1.202886          ?        ? 
1 1 1   35    3    0 o 23.89646 3.238423   38.30526   360.0   6.194862 1.503607   6.194862 1.503607 
1 1 1   35    3    1 o 13.50719 3.683948   9.928355   299.7   2.044906 1.022453          ?        ? 
1 1 1   35    3    2 o 7.563823 3.359960   10.71474   250.4 -0.2405772 1.022453          ?        ? 
1 1 1   35    3    3 f 15.12109 3.539296   41.68573   177.8   2.556132 1.052525          ?        ? 
1 1 1   35    3    4 o 9.454719 3.878062   5.296306   169.7  0.5112265 1.172814          ?        ? 
1 1 1   35    3    5 o 9.181555 3.859349   27.41953   160.4  0.3608657 1.202886          ?        ? 
1 1 1   35    3    6 o 21.46251 2.872352   40.99667    37.5   4.931832 1.232958          ?        ? 
1 1 1   35    3    7 o 21.62005 2.851423   39.95054    71.2   5.022048 1.232958          ?        ? 
1 1 1   35    3    8 o 10.33949 3.784842   11.14844    60.2   1.142741 1.022453          ?        ? 
1 1 1   35    3    9 o 10.88026 4.042826   26.84066   306.3   1.323174 1.172814          ?        ? 
1 1 1   35    4    0 o 25.98615 2.958900   36.16626   180.0   7.187243 1.503607   7.187243 1.503607 
1 1 1   35    4    1 o 19.33147 2.955651   40.11853   175.8   3.939451 1.142741          ?        ? 
1 1 1   35    4    2 o 6.804042 3.239223   4.421482   239.6  -1.323174 1.202886          ?        ? 
1 1 1   35    4    3 o 6.680674 3.151614   16.15134   193.1  -1.112669 1.112669          ?        ? 
1 1 1   35    4    4 o 22.26932 2.970847   39.13345   263.9   5.262625 1.323174          ?        ? 
1 1 1   35    4    5 o 12.44867 4.134791   13.12851   350.7   1.744184 1.202886          ?        ? 
1 1 1   35    4    6 o 10.43236 4.039321   17.75576    26.9  0.9923807 1.202886          ?        ? 
1 1 1   35    4    7 o 17.02209 3.476870   36.82159   111.8   3.307936 1.142741          ?        ? 
1 1 1   35    4    8 o 11.35736 3.812092   23.29767   181.5   1.503607 1.022453          ?        ? 
1 1 1   35    4    9 o 13.72775 4.017869   27.13088    84.3   2.345627 1.172814          ?        ? 
1 1 1   35    5    0 o 7.218403 4.771358   22.35675     0.0      -0.03 1.714112      -0.03 1.714112 
1 1 1   35    5    1 o 6.921891 3.256679   15.31546   151.5  -1.112669 1.172814          ?        ? 
1 1 1   35    5    2 o 17.12868 3.456885   47.98119   129.0   3.247792 1.142741          ?        ? 
1 1 1   35    5    3 o 11.34444 4.016054   23.71947   236.7   1.323174 1.142741          ?        ? 
1 1 1   35    5    4 o 14.26689 4.035268   38.46285   269.5   2.345627 1.202886          ?        ? 
1 1 1   35    5    5 f 16.38106 3.980458   36.74836   309.4   3.127503 1.293102          ?        ? 
1 1 1   35    5    6 o 9.501918 3.884495   6.149875   233.8  0.6014429 1.172814          ?        ? 
1 1 1   35    5    7 o 10.23158 3.866368   18.71507   154.9   1.022453 1.082597          ?        ? 
1 1 1   35    5    8 o 10.89434 3.804479   16.39831   253.4   1.353247 1.022453          ?        ? 
1 1 1   35    5    9 o 9.469774 3.880114   12.60587   144.2  0.7217315 1.172814          ?        ? 
1 1 1   35    6    0 o 10.45159 5.571701   1.103761   180.0   1.774257 1.563751   1.774257 1.563751 
1 1 1   35    6    1 o 14.57849 4.203509   24.02302    35.1   2.435844 1.293102          ?        ? 
1 1 1   35    6    2 o 19.76743 2.890465   30.98960    65.2   4.119884 1.142741          ?        ? 
1 1 1   35    6    3 o 14.48183 4.015727   33.73386   216.1   2.405771 1.202886          ?        ? 
1 1 1   35    6    4 o 14.12671 4.180710   20.77248   128.5   2.315555 1.263030          ?        ? 
1 1 1   35    6    5 f 9.860847 3.970434   22.36583   257.9  0.7217315 1.202886          ?        ? 
1 1 1   35    6    6 o 10.34727 4.032519   13.21200   253.6  0.9623086 1.202886          ?        ? 
1 1 1   35    6    7 o 28.73916 2.040445   46.94423   233.5   8.600634 1.172814          ?        ? 
1 1 1   35    6    8 o 6.631769 3.085947   4.371244   274.9 -0.6315150 0.9923807          ?        ? 
1 1 1   35    6    9 o 11.39825 4.157814   17.09899    43.9   1.533679 1.232958          ?        ? 
1 1 1   35    7    0 o 8.052777 5.202466   6.064974   180.0  0.3608657 1.894545  0.3608657 1.894545 
1 1 1   35    7    1 o 6.661315 3.164595   10.04753   354.9  -1.232958 1.142741          ?        ? 
1 1 1   35    7    2 o 22.94727 2.752027   34.09849   110.5   5.533275 1.263030          ?        ? 
1 1 1   35    7    3 o 19.03571 3.159551   28.49101   342.6   3.879307 1.202886          ?        ? 
1 1 1   35    7    4 o 23.50255 2.559054   40.73699   268.2   5.803924 1.202886          ?        ? 
1 1 1   35    7    5 o 9.849656 3.828251   13.46235   342.8  0.8420200 1.082597          ?        ? 
1 1 1   35    7    6 o 14.67250 3.847005   31.55815   107.1   2.526060 1.142741          ?        ? 
1 1 1   35    7    7 o 11.01301 4.004226   22.34622   317.0   1.323174 1.142741          ?        ? 
1 1 1   35    7    8 o 10.36737 3.785838   9.099575   300.6   1.172814 1.022453          ?        ? 
1 1 1   35    8    0 o 12.33835 6.279958   13.80640   360.0   2.556132 1.924617   2.556132 1.924617 
1 1 1   35    8    1 o 9.517730 3.886650   21.87926    16.9  0.5412986 1.172814          ?        ? 
1 1 1   35    8    2 o 11.27746 4.060869   15.91184   274.8   1.293102 1.172814          ?        ? 
1 1 1   35    8    3 o 8.548244 3.707359   12.41533   196.1       0.06 1.172814          ?        ? 
1 1 1   35    8    4 o 15.43836 4.042845   17.75208   255.9   2.796710 1.263030          ?        ? 
1 1 1   35    8    5 o 12.69156 4.134794   22.34818    10.0   1.864473 1.202886          ?        ? 
1 1 1   35    8    6 o 9.316051 3.791894   21.98409   329.5  0.6014429 1.112669          ?        ? 
1 1 1   35    8    7 o 15.66101 3.702226   21.01054   349.0   2.916998 1.142741          ?        ? 
1 1 1   35    8    8 o 24.60273 1.772349   38.64686    39.0   6.285078 0.8720922          ?        ? 
1 1 1   35    9    0 o 7.048523 4.619617   13.68709   180.0       0.09 1.563751       0.09 1.563751 
1 1 1   35    9    1 o 11.83557 3.922608   19.08539    31.1   1.533679 1.082597          ?        ? 
1 1 1   35    9    2 o 10.86170 4.155074   12.89206   288.0   1.082597 1.263030          ?        ? 
1 1 1   35    9    3 o 7.563030 3.404664   10.76165     8.7 -0.3307936 1.082597          ?        ? 
1 1 1   35    9    4 o 6.510286 3.134117   12.49437    60.1  -1.533679 1.202886          ?        ? 
1 1 1   35    9    5 o 14.81508 3.749940   17.11868   321.7   2.556132 1.112669          ?        ? 
1 1 1   35    9    6 o 5.986142 2.928414   8.132994   252.8  -1.954689 1.172814          ?        ? 
1 1 1   35    9    7 o 7.914555 3.532379   20.24599   277.1 -0.1202886 1.142741          ?        ? 
1 1 1   35    9    8 o 6.003823 2.819957   4.463867    88.7 -0.7217315 0.8720922          ?        ? 
1 1 1   35   10    0 o 13.86618 5.962181   19.78299     0.0   3.007215 1.684040   3.007215 1.684040 
1 1 1   35   10    1 o 10.31423 4.029877   12.39732    36.7  0.9021643 1.202886          ?        ? 
1 1 1   35   10    2 o 20.94354 2.656355   30.50063   136.1   4.631110 1.112669          ?        ? 
1 1 1   35   10    3 o 10.67870 3.943793   14.09233   222.5   1.142741 1.112669          ?        ? 
1 1 1   35   10    4 o 10.51659 4.009485   20.99642   357.8   1.052525 1.172814          ?        ? 
1 1 1   35   10    5 f 20.73578 2.900507   35.41711   266.8   4.631110 1.202886          ?        ? 
1 1 1   35   10    6 o 8.619267 3.671075   14.79162   305.7  0.3007214 1.112669          ?        ? 
1 1 1   35   10    7 o 24.13101 2.492407   31.18466   215.7   6.255006 1.202886          ?        ? 
1 1 1   35   10    8 o 7.937062 3.308280   8.399652   162.8  0.3608657 0.8720922          ?        ? 
1 1 1   35   11    0 o 4.391120 3.223369   6.354448     0.0  -3.007215 1.563751  -3.007215 1.563751 
1 1 1   35   11    1 o 15.82143 3.596820   30.02537   146.4   2.856854 1.112669          ?        ? 
1 1 1   35   11    2 o 13.59354 4.091642   24.52104   170.9   2.165194 1.202886          ?        ? 
1 1 1   35   11    3 o 6.004000 2.927550   9.521668   156.7  -1.834401 1.142741          ?        ? 
1 1 1   35   11    4 o 6.627793 3.136349   15.52428   100.4  -1.082597 1.112669          ?        ? 
1 1 1   35   11    5 o 9.085028 3.726089   18.30664   251.7  0.5412986 1.082597          ?        ? 
1 1 1   35   11    6 o 6.155374 2.955530   6.518939   336.0  -1.232958 1.052525          ?        ? 
1 1 1   35   11    7 o 8.928512 3.531101   12.67706    15.0  0.6916593 0.9322364          ?        ? 
1 1 1   35   12    0 o 5.556689 3.903805   5.242056   180.0  -1.202886 1.563751  -1.202886 1.563751 
1 1 1   35   12    1 o 9.436054 3.842106   24.48318    21.2  0.6014429 1.142741          ?        ? 
1 1 1   35   12    2 o 13.98382 3.855967   25.21163   352.6   2.285483 1.112669          ?        ? 
1 1 1   35   12    3 o 7.659750 3.427882   11.26854    26.0 -0.2405772 1.082597          ?        ? 
1 1 1   35   12    4 o 8.108762 3.514358   9.219954   311.2       0.09 1.052525          ?        ? 
1 1 1   35   12    5 o 7.881866 3.464832   3.523559   296.6   0.000000 1.052525          ?        ? 
1 1 1   35   12    6 f 16.43305 3.663112   30.16589    82.0   3.217719 1.172814          ?        ? 
1 1 1   35   12    7 o 16.17719 2.993958   28.76113    21.2   2.977142 0.9322364          ?        ? 
1 1 1   35   13    0 o 5.414419 3.891579   1.608561   360.0  -2.105050 1.804329  -2.105050 1.804329 
1 1 1   35   13    1 o 12.05009 3.976718   25.78458   288.3   1.653968 1.112669          ?        ? 
1 1 1   35   13    2 o 19.75008 2.969136   36.30980   117.7   4.210100 1.172814          ?        ? 
1 1 1   35   13    3 o 11.21058 3.914789   15.82290   247.3   1.383319 1.082597          ?        ? 
1 1 1   35   13    4 o 8.972092 3.675900   21.01904   119.4  0.5412986 1.052525          ?        ? 
1 1 1   35   13    5 f 9.776900 3.822434   20.05497    32.3  0.9021643 1.082597          ?        ? 
1 1 1   35   13    6 o 13.17160 3.565745   6.255252   328.4   2.074978 0.9623086          ?        ? 
1 1 1   35   13    7 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   35   14    0 o 6.213428 4.255561   6.628534   360.0 -0.5713707 1.593824 -0.5713707 1.593824 
1 1 1   35   14    1 o 10.48144 3.789908   6.462978   114.1   1.142741 1.022453          ?        ? 
1 1 1   35   14    2 o 7.312183 3.367397   5.367692   276.2 -0.6014429 1.142741          ?        ? 
1 1 1   35   14    3 o 8.662835 3.705928   27.74744   345.5  0.2706493 1.142741          ?        ? 
1 1 1   35   14    4 o 14.90430 3.654846   19.09975    85.2   2.646349 1.082597          ?        ? 
1 1 1   35   14    5 o 33.10941 1.998185   53.86366    93.4   11.48756 1.323174          ?        ? 
1 1 1   35   14    6 o 8.814435 3.583297   15.25713   342.8  0.6014429 0.9923807          ?        ? 
1 1 1   35   15    0 o 4.118105 3.043012   4.931531     0.0  -3.398152 1.533679  -3.398152 1.533679 
1 1 1   35   15    1 o 10.61135 3.844413   18.51103   165.8   1.202886 1.052525          ?        ? 
1 1 1   35   15    2 o 9.478673 3.817777   16.55106   245.9  0.7217315 1.112669          ?        ? 
1 1 1   35   15    3 o 12.52964 3.904260   12.11992   145.2   1.894545 1.082597          ?        ? 
1 1 1   35   15    4 o 14.38073 3.732330   16.25326     7.5   2.495988 1.082597          ?        ? 
1 1 1   35   15    5 o 7.670020 3.342676   12.69026   250.9       0.09 0.9623086          ?        ? 
1 1 1   35   16    0 o 10.30211 5.306008   16.77962     0.0   1.834401 1.383319   1.834401 1.383319 
1 1 1   35   16    1 o 7.904973 3.445307   14.93368     4.9       0.09 1.022453          ?        ? 
1 1 1   35   16    2 o 7.379287 3.337561   16.45964   252.5 -0.2706493 1.052525          ?        ? 
1 1 1   35   16    3 o 6.358106 3.007684   3.633637   204.7 -0.9322364 1.022453          ?        ? 
1 1 1   35   16    4 o 14.28607 3.819325   23.57075   316.6   2.495988 1.112669          ?        ? 
1 1 1   35   16    5 o 11.51039 3.694373   16.06012   343.8   1.593824 0.9623086          ?        ? 
1 1 1   35   17    0 o 8.641991 5.178323   5.278973     0.0   1.172814 1.563751   1.172814 1.563751 
1 1 1   35   17    1 f 10.23562 3.904462   12.80300    12.3   1.082597 1.112669          ?        ? 
1 1 1   35   17    2 o 7.473930 3.398468   3.893035   313.4 -0.3307936 1.112669          ?        ? 
1 1 1   35   17    3 o 9.975825 3.880282   18.85011   291.1  0.9923807 1.112669          ?        ? 
1 1 1   35   17    4 o 18.48205 2.766070   27.98827   270.5   3.759018 1.022453          ?        ? 
1 1 1   35   18    0 o 8.261387 4.963972   18.14873    -0.0   1.052525 1.443463   1.052525 1.443463 
1 1 1   35   18    1 o 7.279519 3.269217   9.133651    56.9 -0.1804329 0.9923807          ?        ? 
1 1 1   35   18    2 o 9.082351 3.659076   12.38932   347.0  0.6916593 1.022453          ?        ? 
1 1 1   36    0    0 o 13.18304 8.037757   27.51099   180.0   2.405771 3.909379   2.405771 3.909379 
1 1 1   36    0    1 o 6.085353 4.406062   5.446081   180.0  -3.548513 2.556132  -3.548513 2.556132 
1 1 1   36    0    2 o 9.853497 5.791251   28.91836   180.0   1.533679 1.894545   1.533679 1.894545 
1 1 1   36    0    3 o 6.333763 4.425151   1.613173   180.0  -1.263030 1.954689  -1.263030 1.954689 
1 1 1   36    0    4 o 6.477292 4.418512   12.07113     0.0 -0.5112265 1.684040 -0.5112265 1.684040 
1 1 1   36    0    5 o 6.098587 4.187244   16.03633     0.0 -0.6014429 1.563751 -0.6014429 1.563751 
1 1 1   36    0    6 o 5.698432 4.033913   10.59962     0.0  -1.413391 1.744184  -1.413391 1.744184 
1 1 1   36    0    7 o 8.448440 5.259130   26.27411   180.0  0.9923807 1.744184  0.9923807 1.744184 
1 1 1   36    1    0 o 18.29494 5.885860   38.52554   180.0   4.601038 1.894545   4.601038 1.894545 
1 1 1   36    1    1 o 21.11550 3.489227   23.08478   159.6   4.901759 1.473535          ?        ? 
1 1 1   36    1    2 o 7.681359 3.491807   7.107292    55.2 -0.4510822 1.172814          ?        ? 
1 1 1   36    1    3 o 7.131496 3.281407   10.96709   102.4 -0.6014429 1.082597          ?        ? 
1 1 1   36    1    4 o 12.75539 4.186162   26.10721    18.0   1.894545 1.232958          ?        ? 
1 1 1   36    1    5 o 12.03555 4.226008   21.71790   145.9   1.653968 1.263030          ?        ? 
1 1 1   36    1    6 o 11.99274 4.030099   21.42986    42.6   1.714112 1.142741          ?        ? 
1 1 1   36    1    7 o 6.630985 3.187528   11.13072   118.8  -1.383319 1.232958          ?        ? 
1 1 1   36    2    0 o 20.00140 4.862665   18.97235   180.0   4.931832 1.684040   4.931832 1.684040 
1 1 1   36    2    1 o 13.62891 4.027130   35.51820   239.5   2.165194 1.172814          ?        ? 
1 1 1   36    2    2 o 9.550888 3.954280   29.95325    14.1  0.5412986 1.232958          ?        ? 
1 1 1   36    2    3 o 5.867985 2.890125   13.91763    47.2  -2.285483 1.202886          ?        ? 
1 1 1   36    2    4 o 16.67525 3.704160   30.68711    70.4   3.217719 1.202886          ?        ? 
1 1 1   36    2    5 o 9.677559 3.910613   16.84160   309.8  0.7217315 1.172814          ?        ? 
1 1 1   36    2    6 o 11.99239 4.132400   20.41649   226.6   1.714112 1.202886          ?        ? 
1 1 1   36    2    7 o 10.97540 3.906566   12.63015   355.0   1.383319 1.082597          ?        ? 
1 1 1   36    3    0 o 8.653794 5.407301   16.43831    -0.0  0.8720922 1.864473  0.8720922 1.864473 
1 1 1   36    3    1 o 21.33796 2.607254   37.98202   270.5   4.811543 1.112669          ?        ? 
1 1 1   36    3    2 o 17.25402 3.996773   36.01123   332.9   3.488369 1.353247          ?        ? 
1 1 1   36    3    3 o 9.760663 4.097678   19.67847   286.7  0.5112265 1.353247          ?        ? 
1 1 1   36    3    4 o 10.43488 4.148666   17.64201   260.6  0.9322364 1.293102          ?        ? 
1 1 1   36    3    5 o 10.78263 4.223769   7.900146   221.5   1.112669 1.323174          ?        ? 
1 1 1   36    3    6 o 9.847472 4.029341   19.80449   181.3  0.7818757 1.263030          ?        ? 
1 1 1   36    3    7 o 8.397902 3.773141   14.87419   318.7 -0.1202886 1.323174          ?        ? 
1 1 1   36    4    0 o 7.014616 4.808609   11.89070   360.0 -0.6916593 2.044906 -0.6916593 2.044906 
1 1 1   36    4    1 o 18.57959 3.075260   31.83661   253.3   3.728946 1.142741          ?        ? 
1 1 1   36    4    2 o 8.999887 3.964139   15.44998   108.3   0.000000 1.383319          ?        ? 
1 1 1   36    4    3 o 6.371482 3.108075   10.67962   273.0  -2.044906 1.293102          ?        ? 
1 1 1   36    4    4 o 8.255569 3.737584   23.27265   198.1 -0.3608657 1.323174          ?        ? 
1 1 1   36    4    5 o 13.89937 4.134171   21.74317   146.5   2.345627 1.232958          ?        ? 
1 1 1   36    4    6 o 9.484401 3.969065   15.38788   200.0  0.6014429 1.263030          ?        ? 
1 1 1   36    4    7 o 11.19026 4.226479   15.84284   263.7   1.413391 1.293102          ?        ? 
1 1 1   36    5    0 o 26.02235 3.685452   55.23211   180.0   7.367675 1.864473   7.367675 1.864473 
1 1 1   36    5    1 o 11.57840 4.334627   14.53128   153.2   1.383319 1.353247          ?        ? 
1 1 1   36    5    2 o 8.646141 3.798199   13.93577   133.8   0.000000 1.263030          ?        ? 
1 1 1   36    5    3 o 13.96751 4.129706   30.97454    23.4   2.315555 1.232958          ?        ? 
1 1 1   36    5    4 o 7.735980 3.521874   12.32620   107.6 -0.4510822 1.202886          ?        ? 
1 1 1   36    5    5 o 9.001820 3.798567   11.58160    78.8  0.4210100 1.172814          ?        ? 
1 1 1   36    5    6 o 11.30760 4.061944   14.28978   192.5   1.473535 1.172814          ?        ? 
1 1 1   36    5    7 o 8.312524 3.691464   15.59967   327.5   0.000000 1.232958          ?        ? 
1 1 1   36    6    0 o 9.492302 5.485137   7.191408   180.0   1.443463 1.653968   1.443463 1.653968 
1 1 1   36    6    1 o 10.22133 4.020951   15.44215   316.9  0.9021643 1.202886          ?        ? 
1 1 1   36    6    2 o 24.03679 2.752394   50.60373   297.5   6.164790 1.323174          ?        ? 
1 1 1   36    6    3 o 6.048257 2.945251   8.363851    31.2  -1.774257 1.142741          ?        ? 
1 1 1   36    6    4 o 7.397405 3.424958   14.48019    54.7 -0.6916593 1.202886          ?        ? 
1 1 1   36    6    5 o 8.797983 3.808240   6.118377   293.6  0.2405772 1.232958          ?        ? 
1 1 1   36    6    6 o 11.58070 4.209794   25.03106   258.6   1.563751 1.263030          ?        ? 
1 1 1   36    6    7 o 7.845235 3.616920   12.71267   208.6 -0.5112265 1.323174          ?        ? 
1 1 1   36    7    0 o 30.47628 3.377681   45.08296   180.0   10.07417 2.014834   10.07417 2.014834 
1 1 1   36    7    1 o 9.535705 3.978398   13.29690   235.8  0.5112265 1.263030          ?        ? 
1 1 1   36    7    2 o 13.16914 4.287045   20.92674   316.2   2.044906 1.293102          ?        ? 
1 1 1   36    7    3 o 12.37406 4.134791   23.36493    36.6   1.774257 1.202886          ?        ? 
1 1 1   36    7    4 o 10.61922 4.094081   9.877628    96.1   1.112669 1.232958          ?        ? 
1 1 1   36    7    5 o 6.880294 3.230923   16.13713   135.5 -0.8720922 1.142741          ?        ? 
1 1 1   36    7    6 o 9.627518 3.934601   19.72668   211.9  0.7518036 1.202886          ?        ? 
1 1 1   36    7    7 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   36    8    0 o 5.031441 3.642164   3.424421     0.0  -2.405771 1.714112  -2.405771 1.714112 
1 1 1   36    8    1 o 11.92703 4.176586   30.64022   314.1   1.593824 1.232958          ?        ? 
1 1 1   36    8    2 o 10.04216 4.087679   17.34116   358.0  0.7518036 1.293102          ?        ? 
1 1 1   36    8    3 o 13.17926 4.117211   25.93645    54.5   2.074978 1.202886          ?        ? 
1 1 1   36    8    4 o 8.871339 3.773424   23.12092    53.7  0.3608657 1.172814          ?        ? 
1 1 1   36    8    5 o 17.16205 3.617607   25.83314   163.3   3.488369 1.202886          ?        ? 
1 1 1   36    8    6 o 8.340674 3.682327   8.581635   292.3       0.06 1.202886          ?        ? 
1 1 1   36    9    0 o 6.659641 4.497237   9.405896   360.0 -0.3307936 1.684040 -0.3307936 1.684040 
1 1 1   36    9    1 o 12.28725 4.134795   16.37154   205.8   1.744184 1.202886          ?        ? 
1 1 1   36    9    2 o 15.20630 4.000141   27.27057   280.0   2.766637 1.232958          ?        ? 
1 1 1   36    9    3 o 7.072718 3.344373   12.81657    33.3  -1.112669 1.263030          ?        ? 
1 1 1   36    9    4 o 10.61418 3.981344   16.64653    88.6   1.202886 1.142741          ?        ? 
1 1 1   36    9    5 o 7.952435 3.617321   9.066143    37.5 -0.3307936 1.263030          ?        ? 
1 1 1   36    9    6 o 8.245790 3.749031   11.79586     8.0 -0.2706493 1.353247          ?        ? 
1 1 1   36   10    0 o 13.64287 6.227306   2.533965   180.0   3.127503 1.834401   3.127503 1.834401 
1 1 1   36   10    1 o 16.68573 3.781405   24.44283   184.4   3.277864 1.232958          ?        ? 
1 1 1   36   10    2 o 6.305902 3.040383   10.96144   260.5  -1.443463 1.142741          ?        ? 
1 1 1   36   10    3 o 16.27408 3.844589   26.13453   199.9   3.187647 1.232958          ?        ? 
1 1 1   36   10    4 o 6.978273 3.220511   8.321837   210.7 -0.5412986 1.052525          ?        ? 
1 1 1   36   10    5 o 10.50594 4.008301   7.235761    17.2   1.172814 1.172814          ?        ? 
1 1 1   36   11    0 o 12.12637 5.832784   17.73459   180.0   2.526060 1.623896   2.526060 1.623896 
1 1 1   36   11    1 o 9.043385 3.806484   24.61369   208.6  0.4510822 1.172814          ?        ? 
1 1 1   36   11    2 f 10.17670 4.080544   18.78028    63.8  0.9322364 1.263030          ?        ? 
1 1 1   36   11    3 o 7.904585 3.551861   27.83234   128.7 -0.1804329 1.172814          ?        ? 
1 1 1   36   11    4 o 7.141214 3.264694   19.86897    83.4 -0.4210100 1.052525          ?        ? 
1 1 1   36   11    5 o 8.068172 3.479809   12.10473   144.7  0.2105050 1.022453          ?        ? 
1 1 1   36   12    0 f 20.49868 4.816976   18.39978   180.0   5.262625 1.714112   5.262625 1.714112 
1 1 1   36   12    1 o 8.407821 3.734693   10.77922   214.0      -0.03 1.263030          ?        ? 
1 1 1   36   12    2 o 8.657891 3.678798   12.59521    20.4  0.3608657 1.112669          ?        ? 
1 1 1   36   12    3 o 22.72423 2.712871   39.79337    25.0   5.623491 1.232958          ?        ? 
1 1 1   36   12    4 o 8.254200 3.570613   9.682793   295.9  0.2105050 1.082597          ?        ? 
1 1 1   36   13    0 o 8.279483 5.064901  0.1869823     0.0  0.9923807 1.563751  0.9923807 1.563751 
1 1 1   36   13    1 o 11.31447 3.812093   17.50863   326.8   1.503607 1.022453          ?        ? 
1 1 1   36   13    2 o 13.33978 4.168558   22.06604     7.4   2.225339 1.232958          ?        ? 
1 1 1   36   13    3 o 12.38647 4.134791   18.30720   324.0   1.894545 1.202886          ?        ? 
1 1 1   36   13    4 o 11.49934 3.812090   12.94855    29.3   1.593824 1.022453          ?        ? 
1 1 1   36   14    0 o 8.579268 5.019850   5.643187     0.0   1.202886 1.413391   1.202886 1.413391 
1 1 1   36   14    1 o 9.889343 3.790159   15.92571   277.7  0.9923807 1.052525          ?        ? 
1 1 1   36   14    2 o 9.216978 3.744078   18.55568   248.9  0.6916593 1.082597          ?        ? 
1 1 1   36   14    3 o 9.999306 3.802379   16.29388    35.4   1.052525 1.052525          ?        ? 
1 1 1   36   15    0 o 12.59882 5.952963   2.582712   180.0   2.796710 1.684040   2.796710 1.684040 
1 1 1   36   15    1 o 7.421395 3.368613   11.89133    76.6 -0.2706493 1.082597          ?        ? 
1 1 1   37    0    1 f 7.319705 4.986497   5.780780   270.0 -0.3909379 2.135122 -0.3909379 2.135122 
1 1 1   37    0    2 o 6.673841 4.503860   18.97407    90.0 -0.2405772 1.684040 -0.2405772 1.684040 
1 1 1   37    0    3 o 5.866785 4.178966   4.776454    90.0  -1.744184 1.954689  -1.744184 1.954689 
1 1 1   37    0    4 o 17.10280 5.497615   45.75765    90.0   4.119884 1.653968   4.119884 1.653968 
1 1 1   37    0    5 o 5.883861 4.158694   6.201467   270.0  -1.353247 1.834401  -1.353247 1.834401 
1 1 1   37    1    0 o 14.14152 5.948741   28.81810     0.0   3.217719 1.684040   3.217719 1.684040 
1 1 1   37    1    1 o 9.472425 4.152779   13.82823   324.0  0.2405772 1.503607          ?        ? 
1 1 1   37    1    2 o 7.695868 3.610172   22.34019   358.0 -0.9322364 1.413391          ?        ? 
1 1 1   37    1    3 o 9.534386 4.101512   12.57341   125.4  0.4510822 1.413391          ?        ? 
1 1 1   37    1    4 o 7.486622 3.508604   10.37700    82.7 -0.8420200 1.323174          ?        ? 
1 1 1   37    1    5 o 13.70053 4.146219   32.34873   147.7   2.375700 1.232958          ?        ? 
1 1 1   37    2    0 o 12.67467 6.229343   38.23327     0.0   2.856854 1.864473   2.856854 1.864473 
1 1 1   37    2    1 o 13.11065 4.610222   17.18545   153.7   2.135122 1.503607          ?        ? 
1 1 1   37    2    2 o 12.94491 4.336607   29.22211   100.2   2.074978 1.323174          ?        ? 
1 1 1   37    2    3 o 10.13669 4.073874   18.36479    39.2  0.9322364 1.263030          ?        ? 
1 1 1   37    2    4 o 10.25602 3.944072   17.73232   216.2   1.082597 1.142741          ?        ? 
1 1 1   37    2    5 o 11.62623 4.165947   19.79100   251.7   1.623896 1.232958          ?        ? 
1 1 1   37    3    0 o 7.171823 4.752175   14.84908   180.0  0.1202886 1.714112  0.1202886 1.714112 
1 1 1   37    3    1 o 29.63063 2.740232   55.41212    79.7   9.532870 1.623896          ?        ? 
1 1 1   37    3    2 o 13.27645 4.573839   30.60831   162.1   2.225339 1.473535          ?        ? 
1 1 1   37    3    3 o 12.11738 4.228742   9.402924   186.6   1.774257 1.263030          ?        ? 
1 1 1   37    3    4 o 7.714356 3.514663   6.427230   171.0 -0.3608657 1.202886          ?        ? 
1 1 1   37    3    5 o 11.13923 4.327834   21.18354   317.3   1.383319 1.383319          ?        ? 
1 1 1   37    4    0 o 16.60755 6.028577   40.36127    -0.0   4.149956 1.834401   4.149956 1.834401 
1 1 1   37    4    1 o 10.61479 4.133061   28.53627    43.5   1.142741 1.263030          ?        ? 
1 1 1   37    4    2 o 8.317295 3.692789   22.70105   110.8      -0.03 1.232958          ?        ? 
1 1 1   37    4    3 o 8.707656 3.834073   4.373068    80.8  0.1202886 1.293102          ?        ? 
1 1 1   37    4    4 o 12.59999 4.465799   12.89945   290.2   1.984761 1.413391          ?        ? 
1 1 1   37    4    5 x        ?      ?          ?       ?          ?        ?          ?        ? 
1 1 1   37    5    0 o 10.27396 5.835301   3.210674   360.0   1.894545 1.834401   1.894545 1.834401 
1 1 1   37    5    1 o 12.68094 4.425520   25.14225     5.2   1.984761 1.383319          ?        ? 
1 1 1   37    5    2 o 9.711156 4.063116   25.55729   258.3  0.6615872 1.323174          ?        ? 
1 1 1   37    5    3 o 9.703674 4.111560   13.47129    98.6  0.6014429 1.383319          ?        ? 
1 1 1   37    5    4 o 10.04224 4.174958   26.03983   191.0  0.8119479 1.383319          ?        ? 
1 1 1   37    6    0 o 8.901079 5.399367   24.65583   360.0   1.232958 1.744184   1.232958 1.744184 
1 1 1   37    6    1 o 8.258319 3.698971   13.41157    30.2 -0.1202886 1.263030          ?        ? 
1 1 1   37    6    2 f 8.335264 3.737859   19.89903   277.0 -0.1202886 1.293102          ?        ? 
1 1 1   37    6    3 o 9.164756 3.907575   8.743958    96.7  0.4510822 1.263030          ?        ? 
1 1 1   37    6    4 o 8.119750 3.695835   18.87790     5.6 -0.3007214 1.323174          ?        ? 
1 1 1   37    7    0 o 7.300233 4.915128   4.641889     0.0 -0.1202886 1.984761 -0.1202886 1.984761 
1 1 1   37    7    1 o 14.58566 4.072535   21.80245   140.8   2.646349 1.232958          ?        ? 
1 1 1   37    7    2 o 8.759772 3.823445   6.489668    34.5  0.2105050 1.263030          ?        ? 
1 1 1   37    7    3 o 12.36888 4.236901   17.52582   123.5   1.894545 1.263030          ?        ? 
1 1 1   37    7    4 x        ?      ?   25.16401   123.1          ?        ?          ?        ? 
1 1 1   37    8    0 o 8.197641 5.110809   16.88508   180.0  0.9021643 1.653968  0.9021643 1.653968 
1 1 1   37    8    1 o 11.06640 4.212711   23.51881   170.9   1.353247 1.293102          ?        ? 
1 1 1   37    8    2 o 7.634499 3.508235   19.16690   100.4 -0.4811543 1.232958          ?        ? 
1 1 1   37    8    3 o 10.00169 4.022817   14.95070   213.0  0.9322364 1.232958          ?        ? 
1 1 1   37    9    0 o 6.739888 4.560123   13.53073   360.0 -0.2405772 1.744184 -0.2405772 1.744184 
1 1 1   37    9    1 o 6.229157 3.054335   16.01510   152.5  -2.074978 1.293102          ?        ? 
1 1 1   37    9    2 o 8.364830 3.689036   24.00089   125.0       0.09 1.202886          ?        ? 
1 1 1   37   10    0 o 5.526412 3.923831   3.905169     0.0  -1.413391 1.684040  -1.413391 1.684040 
1 1 1   37   10    1 o 11.32832 4.198200   14.46540   301.8   1.503607 1.263030          ?        ? 
#END OF REFLECTIONS
